4-(phenylcarbonyl)-1-[(1-pyridin-4-ylpiperidin-4-yl)methyl]-3,5-dihydro-1,4-benzodiazepin-2-one

Systemtic Name: 4-(phenylcarbonyl)-1-[(1-pyridin-4-ylpiperidin-4-yl)methyl]-3,5-dihydro-1,4-benzodiazepin-2-one Openeye Name: 4-benzoyl-1-[[1-(4-pyridyl)-4-piperidyl]methyl]-3,5-dihydro-1,4-benzodiazepin-2-one CAS Name: 4-benzoyl-1-[(1-pyridin-4-yl-4-piperidinyl)methyl]-3,5-dihydro-1,4-benzodiazepin-2-one IUPAC Name: 4-benzoyl-1-[(1-pyridin-4-ylpiperidin-4-yl)methyl]-3,5-dihydro-1,4-benzodiazepin-2-one Traditional Name: 4-benzoyl-1-[[1-(4-pyridyl)-4-piperidyl]methyl]-3,5-dihydro-1,4-benzodiazepin-2-one Formula: C27H28N4O2 MolecularWeight: 440.53682

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CN2C(=O)CN(CC3=CC=CC=C32)C(=O)C4=CC=CC=C4)C5=CC=NC=C5

Isomeric SMILES

C1CN(CCC1CN2C(=O)CN(CC3=CC=CC=C32)C(=O)C4=CC=CC=C4)C5=CC=NC=C5

InChI

InChI=1S/C27H28N4O2/c32-26-20-30(27(33)22-6-2-1-3-7-22)19-23-8-4-5-9-25(23)31(26)18-21-12-16-29(17-13-21)24-10-14-28-15-11-24/h1-11,14-15,21H,12-13,16-20H2