4-(4-chloranyl-2-methoxy-phenyl)carbonyl-1-[(1-pyridin-4-ylpiperidin-4-yl)methyl]-3,5-dihydro-1,4-benzodiazepin-2-one

Systemtic Name: 4-(4-chloranyl-2-methoxy-phenyl)carbonyl-1-[(1-pyridin-4-ylpiperidin-4-yl)methyl]-3,5-dihydro-1,4-benzodiazepin-2-one Openeye Name: 4-(4-chloro-2-methoxy-benzoyl)-1-[[1-(4-pyridyl)-4-piperidyl]methyl]-3,5-dihydro-1,4-benzodiazepin-2-one CAS Name: 4-[(4-chloro-2-methoxyphenyl)-oxomethyl]-1-[(1-pyridin-4-yl-4-piperidinyl)methyl]-3,5-dihydro-1,4-benzodiazepin-2-one IUPAC Name: 4-(4-chloro-2-methoxybenzoyl)-1-[(1-pyridin-4-ylpiperidin-4-yl)methyl]-3,5-dihydro-1,4-benzodiazepin-2-one Traditional Name: 4-(4-chloro-2-methoxy-benzoyl)-1-[[1-(4-pyridyl)-4-piperidyl]methyl]-3,5-dihydro-1,4-benzodiazepin-2-one Formula: C28H29ClN4O3 MolecularWeight: 505.00786

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)Cl)C(=O)N2CC3=CC=CC=C3N(C(=O)C2)CC4CCN(CC4)C5=CC=NC=C5

Isomeric SMILES

COC1=C(C=CC(=C1)Cl)C(=O)N2CC3=CC=CC=C3N(C(=O)C2)CC4CCN(CC4)C5=CC=NC=C5

InChI

InChI=1S/C28H29ClN4O3/c1-36-26-16-22(29)6-7-24(26)28(35)32-18-21-4-2-3-5-25(21)33(27(34)19-32)17-20-10-14-31(15-11-20)23-8-12-30-13-9-23/h2-9,12-13,16,20H,10-11,14-15,17-19H2,1H3