6-(4-methylpiperazin-1-yl)-N-(2-oxidanylidene-5-phenyl-1,3-dihydro-1,4-benzodiazepin-3-yl)pyridine-3-carboxamide

Systemtic Name: 6-(4-methylpiperazin-1-yl)-N-(2-oxidanylidene-5-phenyl-1,3-dihydro-1,4-benzodiazepin-3-yl)pyridine-3-carboxamide Openeye Name: 6-(4-methylpiperazin-1-yl)-N-(2-oxo-5-phenyl-1,3-dihydro-1,4-benzodiazepin-3-yl)pyridine-3-carboxamide CAS Name: 6-(4-methyl-1-piperazinyl)-N-(2-oxo-5-phenyl-1,3-dihydro-1,4-benzodiazepin-3-yl)-3-pyridinecarboxamide IUPAC Name: 6-(4-methylpiperazin-1-yl)-N-(2-oxo-5-phenyl-1,3-dihydro-1,4-benzodiazepin-3-yl)pyridine-3-carboxamide Traditional Name: N-(2-keto-5-phenyl-1,3-dihydro-1,4-benzodiazepin-3-yl)-6-(4-methylpiperazino)nicotinamide Formula: C26H26N6O2 MolecularWeight: 454.52364

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=NC=C(C=C2)C(=O)NC3C(=O)NC4=CC=CC=C4C(=N3)C5=CC=CC=C5

Isomeric SMILES

CN1CCN(CC1)C2=NC=C(C=C2)C(=O)NC3C(=O)NC4=CC=CC=C4C(=N3)C5=CC=CC=C5

InChI

InChI=1S/C26H26N6O2/c1-31-13-15-32(16-14-31)22-12-11-19(17-27-22)25(33)30-24-26(34)28-21-10-6-5-9-20(21)23(29-24)18-7-3-2-4-8-18/h2-12,17,24H,13-16H2,1H3,(H,28,34)(H,30,33)