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

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

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=CC=CC3=C2C(=NC(C(=O)N3)NC(=O)C4=CN=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CN1CCN(CC1)C2=CC=CC3=C2C(=NC(C(=O)N3)NC(=O)C4=CN=CC=C4)C5=CC=CC=C5

InChI

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