phenyl N-(1,2-benzodiazepin-1-ylcarbothioyl)carbamate

Systemtic Name: phenyl N-(1,2-benzodiazepin-1-ylcarbothioyl)carbamate Openeye Name: phenyl N-(1,2-benzodiazepine-1-carbothioyl)carbamate CAS Name: N-[1,2-benzodiazepin-1-yl(sulfanylidene)methyl]carbamic acid phenyl ester IUPAC Name: phenyl N-(1,2-benzodiazepine-1-carbothioyl)carbamate Traditional Name: N-(1,2-benzodiazepine-1-carbothioyl)carbamic acid phenyl ester Formula: C17H13N3O2S MolecularWeight: 323.36902

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC(=O)NC(=S)N2C3=CC=CC=C3C=CC=N2

Isomeric SMILES

C1=CC=C(C=C1)OC(=O)NC(=S)N2C3=CC=CC=C3C=CC=N2

InChI

InChI=1S/C17H13N3O2S/c21-17(22-14-9-2-1-3-10-14)19-16(23)20-15-11-5-4-7-13(15)8-6-12-18-20/h1-12H,(H,19,21,23)