4-(2,4-Dimethylphenyl)-1-mercapto[1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one

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Catalog Number
ACM85772367
Product Name
4-(2,4-Dimethylphenyl)-1-mercapto[1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one
Structure
Structure
CAS
85772-36-7
Category
Heterocyclic Organic Compound
Synonyms
4-(2,4-dimethylphenyl)-1-mercapto[1,2,4]triazolo[4,3-a]quinazolin-5(4H)-one, 85772-36-7, AC1NFG5W, AC1Q2M60, CTK5F5746, MolPort-002-465-826, AKOS005198681, AG-H-45820, MCULE-8370460851, EN300-08203, AB00721019-01, T0518-7988, 4-(2,4-dimethylphenyl)-1-sulfanylidene-2H-[1,2,4]triazolo[4,3-a]quinazolin-5-one
IUPAC Name
4-(2,4-dimethylphenyl)-1-sulfanylidene-2H-[1,2,4]triazolo[4,3-a]quinazolin-5-one
Molecular Weight
322.384260 [g/mol]
Molecular Formula
C17H14N4OS
Canonical SMILES
CC1=CC(=C(C=C1)N2C(=O)C3=CC=CC=C3N4C2=NNC4=S)C
InChI Key
YAJUUBCNFFANJR-UHFFFAOYSA-N
Boiling Point
482.5ºC at 760 mmHg
Flash Point
245.6ºC
Density
1.41g/cm³
Exact Mass
322.08900
H-Bond Acceptor
3
H-Bond Donor
1
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