CAS
947701-96-4 Purity
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947701-96-4 Purity
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2H-Tetrazole-2-acetic acid,5-(3,4-dimethoxyphenyl)-,2-((phenylamino)thioxomethyl)hydrazide
CAS
94771-94-5
Catalog Number
ACM94771945
Category
Other Products
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What is the molecular formula of 2H-Tetrazole-2-acetic acid, 5-(3,4-dimethoxyphenyl)-, 2-((phenylamino)thioxomethyl)hydrazide?
The molecular formula is C18H19N7O3S.
When was 2H-Tetrazole-2-acetic acid, 5-(3,4-dimethoxyphenyl)-, 2-((phenylamino)thioxomethyl)hydrazide created and modified according to PubChem?
It was created on 2005-08-08 and modified on 2023-12-30.
What is the IUPAC Name of 2H-Tetrazole-2-acetic acid, 5-(3,4-dimethoxyphenyl)-, 2-((phenylamino)thioxomethyl)hydrazide?
The IUPAC Name is 1-[[2-[5-(3,4-dimethoxyphenyl)tetrazol-2-yl]acetyl]amino]-3-phenylthiourea.
What is the InChIKey of 2H-Tetrazole-2-acetic acid, 5-(3,4-dimethoxyphenyl)-, 2-((phenylamino)thioxomethyl)hydrazide?
The InChIKey is OXDSEFQDFWEXEU-UHFFFAOYSA-N.
How many Hydrogen Bond Donor Count does 2H-Tetrazole-2-acetic acid, 5-(3,4-dimethoxyphenyl)-, 2-((phenylamino)thioxomethyl)hydrazide have?
It has 3 Hydrogen Bond Donor Count.
What is the Canonical SMILES of 2H-Tetrazole-2-acetic acid, 5-(3,4-dimethoxyphenyl)-, 2-((phenylamino)thioxomethyl)hydrazide?
The Canonical SMILES is COC1=C(C=C(C=C1)C2=NN(N=N2)CC(=O)NNC(=S)NC3=CC=CC=C3)OC.
What is the Molecular Weight of 2H-Tetrazole-2-acetic acid, 5-(3,4-dimethoxyphenyl)-, 2-((phenylamino)thioxomethyl)hydrazide?
The Molecular Weight is 413.5 g/mol.
How many Rotatable Bond Count does 2H-Tetrazole-2-acetic acid, 5-(3,4-dimethoxyphenyl)-, 2-((phenylamino)thioxomethyl)hydrazide have?
It has 6 Rotatable Bond Count.
Is 2H-Tetrazole-2-acetic acid, 5-(3,4-dimethoxyphenyl)-, 2-((phenylamino)thioxomethyl)hydrazide Canonicalized?
Yes, it is canonicalized.
What is the Topological Polar Surface Area of 2H-Tetrazole-2-acetic acid, 5-(3,4-dimethoxyphenyl)-, 2-((phenylamino)thioxomethyl)hydrazide?
The Topological Polar Surface Area is 147 Ų.
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