1,3-dimethyl-N-(4-methylpiperazin-1-yl)-4-oxidanylidene-5H-thieno[3,4-b][1,5]benzodiazepine-10-carboxamide

Systemtic Name: 1,3-dimethyl-N-(4-methylpiperazin-1-yl)-4-oxidanylidene-5H-thieno[3,4-b][1,5]benzodiazepine-10-carboxamide Openeye Name: 1,3-dimethyl-N-(4-methylpiperazin-1-yl)-4-oxo-5H-thieno[3,4-b][1,5]benzodiazepine-10-carboxamide CAS Name: 1,3-dimethyl-N-(4-methyl-1-piperazinyl)-4-oxo-5H-thieno[3,4-b][1,5]benzodiazepine-10-carboxamide IUPAC Name: 1,3-dimethyl-N-(4-methylpiperazin-1-yl)-4-oxo-5H-thieno[3,4-b][1,5]benzodiazepine-10-carboxamide Traditional Name: 4-keto-1,3-dimethyl-N-(4-methylpiperazino)-5H-thieno[3,4-b][1,5]benzodiazepine-10-carboxamide Formula: C19H23N5O2S MolecularWeight: 385.48322

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(S1)C)N(C3=CC=CC=C3NC2=O)C(=O)NN4CCN(CC4)C

Isomeric SMILES

CC1=C2C(=C(S1)C)N(C3=CC=CC=C3NC2=O)C(=O)NN4CCN(CC4)C

InChI

InChI=1S/C19H23N5O2S/c1-12-16-17(13(2)27-12)24(15-7-5-4-6-14(15)20-18(16)25)19(26)21-23-10-8-22(3)9-11-23/h4-7H,8-11H2,1-3H3,(H,20,25)(H,21,26)