4-(6-chloranylpyridin-3-yl)carbonyl-1-[(1-pyridin-4-ylpiperidin-4-yl)methyl]-3,5-dihydro-1,4-benzodiazepin-2-one

Systemtic Name: 4-(6-chloranylpyridin-3-yl)carbonyl-1-[(1-pyridin-4-ylpiperidin-4-yl)methyl]-3,5-dihydro-1,4-benzodiazepin-2-one Openeye Name: 4-(6-chloropyridine-3-carbonyl)-1-[[1-(4-pyridyl)-4-piperidyl]methyl]-3,5-dihydro-1,4-benzodiazepin-2-one CAS Name: 4-[(6-chloro-3-pyridinyl)-oxomethyl]-1-[(1-pyridin-4-yl-4-piperidinyl)methyl]-3,5-dihydro-1,4-benzodiazepin-2-one IUPAC Name: 4-(6-chloropyridine-3-carbonyl)-1-[(1-pyridin-4-ylpiperidin-4-yl)methyl]-3,5-dihydro-1,4-benzodiazepin-2-one Traditional Name: 4-(6-chloronicotinoyl)-1-[[1-(4-pyridyl)-4-piperidyl]methyl]-3,5-dihydro-1,4-benzodiazepin-2-one Formula: C26H26ClN5O2 MolecularWeight: 475.96994

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H26ClN5O2/c27-24-6-5-20(15-29-24)26(34)31-17-21-3-1-2-4-23(21)32(25(33)18-31)16-19-9-13-30(14-10-19)22-7-11-28-12-8-22/h1-8,11-12,15,19H,9-10,13-14,16-18H2