(phenylmethyl) 1-methyl-4-oxidanylidene-5H-thieno[3,4-b][1,5]benzodiazepine-10-carboxylate

Systemtic Name: (phenylmethyl) 1-methyl-4-oxidanylidene-5H-thieno[3,4-b][1,5]benzodiazepine-10-carboxylate Openeye Name: benzyl 1-methyl-4-oxo-5H-thieno[3,4-b][1,5]benzodiazepine-10-carboxylate CAS Name: 1-methyl-4-oxo-5H-thieno[3,4-b][1,5]benzodiazepine-10-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 1-methyl-4-oxo-5H-thieno[3,4-b][1,5]benzodiazepine-10-carboxylate Traditional Name: 4-keto-1-methyl-5H-thieno[3,4-b][1,5]benzodiazepine-10-carboxylic acid benzyl ester Formula: C20H16N2O3S MolecularWeight: 364.41764

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CS1)C(=O)NC3=CC=CC=C3N2C(=O)OCC4=CC=CC=C4

Isomeric SMILES

CC1=C2C(=CS1)C(=O)NC3=CC=CC=C3N2C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C20H16N2O3S/c1-13-18-15(12-26-13)19(23)21-16-9-5-6-10-17(16)22(18)20(24)25-11-14-7-3-2-4-8-14/h2-10,12H,11H2,1H3,(H,21,23)