N-[2-[4-(7-methoxy-2-oxidanylidene-4,5-dihydro-1H-1,3-benzodiazepin-3-yl)piperidin-1-yl]ethyl]-7-methyl-3H-benzimidazole-5-carboxamide

Systemtic Name: N-[2-[4-(7-methoxy-2-oxidanylidene-4,5-dihydro-1H-1,3-benzodiazepin-3-yl)piperidin-1-yl]ethyl]-7-methyl-3H-benzimidazole-5-carboxamide Openeye Name: N-[2-[4-(7-methoxy-2-oxo-4,5-dihydro-1H-1,3-benzodiazepin-3-yl)-1-piperidyl]ethyl]-7-methyl-3H-benzimidazole-5-carboxamide CAS Name: N-[2-[4-(7-methoxy-2-oxo-4,5-dihydro-1H-1,3-benzodiazepin-3-yl)-1-piperidinyl]ethyl]-7-methyl-3H-benzimidazole-5-carboxamide IUPAC Name: N-[2-[4-(7-methoxy-2-oxo-4,5-dihydro-1H-1,3-benzodiazepin-3-yl)piperidin-1-yl]ethyl]-7-methyl-3H-benzimidazole-5-carboxamide Traditional Name: N-[2-[4-(2-keto-7-methoxy-4,5-dihydro-1H-1,3-benzodiazepin-3-yl)piperidino]ethyl]-7-methyl-3H-benzimidazole-5-carboxamide Formula: C26H32N6O3 MolecularWeight: 476.57068

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1)C(=O)NCCN3CCC(CC3)N4CCC5=C(C=CC(=C5)OC)NC4=O)NC=N2

Isomeric SMILES

CC1=C2C(=CC(=C1)C(=O)NCCN3CCC(CC3)N4CCC5=C(C=CC(=C5)OC)NC4=O)NC=N2

InChI

InChI=1S/C26H32N6O3/c1-17-13-19(15-23-24(17)29-16-28-23)25(33)27-8-12-31-9-6-20(7-10-31)32-11-5-18-14-21(35-2)3-4-22(18)30-26(32)34/h3-4,13-16,20H,5-12H2,1-2H3,(H,27,33)(H,28,29)(H,30,34)