3-[1-[4-(2-azanyl-3-pyridin-4-yl-propanoyl)-3-(oxidanylidenemethylidene)-1-pyridin-4-yl-piperazin-2-yl]piperidin-4-yl]-1H-benzimidazol-2-one

Systemtic Name: 3-[1-[4-(2-azanyl-3-pyridin-4-yl-propanoyl)-3-(oxidanylidenemethylidene)-1-pyridin-4-yl-piperazin-2-yl]piperidin-4-yl]-1H-benzimidazol-2-one Openeye Name: 3-[1-[4-[2-amino-3-(4-pyridyl)propanoyl]-3-(oxomethylene)-1-(4-pyridyl)piperazin-2-yl]-4-piperidyl]-1H-benzimidazol-2-one CAS Name: 3-[1-[4-(2-amino-1-oxo-3-pyridin-4-ylpropyl)-3-(oxomethylidene)-1-pyridin-4-yl-2-piperazinyl]-4-piperidinyl]-1H-benzimidazol-2-one IUPAC Name: 3-[1-[4-(2-amino-3-pyridin-4-ylpropanoyl)-3-(oxomethylidene)-1-pyridin-4-ylpiperazin-2-yl]piperidin-4-yl]-1H-benzimidazol-2-one Traditional Name: 3-[1-[4-[2-amino-3-(4-pyridyl)propanoyl]-3-(ketomethylene)-1-(4-pyridyl)piperazin-2-yl]-4-piperidyl]-1H-benzimidazol-2-one Formula: C30H32N8O3 MolecularWeight: 552.62688

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2C3=CC=CC=C3NC2=O)C4C(=C=O)N(CCN4C5=CC=NC=C5)C(=O)C(CC6=CC=NC=C6)N

Isomeric SMILES

C1CN(CCC1N2C3=CC=CC=C3NC2=O)C4C(=C=O)N(CCN4C5=CC=NC=C5)C(=O)C(CC6=CC=NC=C6)N

InChI

InChI=1S/C30H32N8O3/c31-24(19-21-5-11-32-12-6-21)29(40)37-18-17-36(22-7-13-33-14-8-22)28(27(37)20-39)35-15-9-23(10-16-35)38-26-4-2-1-3-25(26)34-30(38)41/h1-8,11-14,23-24,28H,9-10,15-19,31H2,(H,34,41)