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

Systemtic Name: (1,3-dimethylpiperidin-4-yl) 4-oxidanylidene-5H-thieno[3,4-b][1,5]benzodiazepine-10-carboxylate Openeye Name: (1,3-dimethyl-4-piperidyl) 4-oxo-5H-thieno[3,4-b][1,5]benzodiazepine-10-carboxylate CAS Name: 4-oxo-5H-thieno[3,4-b][1,5]benzodiazepine-10-carboxylic acid (1,3-dimethyl-4-piperidinyl) ester IUPAC Name: (1,3-dimethylpiperidin-4-yl) 4-oxo-5H-thieno[3,4-b][1,5]benzodiazepine-10-carboxylate Traditional Name: 4-keto-5H-thieno[3,4-b][1,5]benzodiazepine-10-carboxylic acid (1,3-dimethyl-4-piperidyl) ester Formula: C19H21N3O3S MolecularWeight: 371.45334

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCC1OC(=O)N2C3=CC=CC=C3NC(=O)C4=CSC=C42)C

Isomeric SMILES

CC1CN(CCC1OC(=O)N2C3=CC=CC=C3NC(=O)C4=CSC=C42)C

InChI

InChI=1S/C19H21N3O3S/c1-12-9-21(2)8-7-17(12)25-19(24)22-15-6-4-3-5-14(15)20-18(23)13-10-26-11-16(13)22/h3-6,10-12,17H,7-9H2,1-2H3,(H,20,23)