Carbamic acid,[(1S)-2-methyl-1-[(6-nitro-1H-benzotriazol-1-yl)thioxomethyl]propyl]-,1,1-dimethylethyl ester(9ci)

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Catalog Number
ACM184951880
Product Name
Carbamic acid,[(1S)-2-methyl-1-[(6-nitro-1H-benzotriazol-1-yl)thioxomethyl]propyl]-,1,1-dimethylethyl ester(9ci)
Structure
Structure
CAS
184951-88-0
Category
Heterocyclic Organic Compound
Synonyms
Boc-ThionoVal-1-(6-nitro)benzotriazolide, 184951-88-0, PubChem11485, AKOS015909252, FT-0603894, I14-33317
IUPAC Name
tert-butyl N-[(2S)-3-methyl-1-(6-nitrobenzotriazol-1-yl)-1-sulfanylidenebutan-2-yl]carbamate
Molecular Weight
379.43
Molecular Formula
C16H21N5O4S
Canonical SMILES
CC(C)C(C(=S)N1C2=C(C=CC(=C2)[N+](=O)[O-])N=N1)NC(=O)OC(C)(C)C
InChI Key
XFVHUHJBRJYSAP-ZDUSSCGKSA-N
Exact Mass
379.13100
H-Bond Acceptor
7
H-Bond Donor
1
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