7-(1,4-diazepan-1-ylcarbonyl)-2-(4-methylphenyl)-1-pyridin-4-ylcarbonyl-3,5-dihydro-2H-1,5-benzodiazepin-4-one

Systemtic Name: 7-(1,4-diazepan-1-ylcarbonyl)-2-(4-methylphenyl)-1-pyridin-4-ylcarbonyl-3,5-dihydro-2H-1,5-benzodiazepin-4-one Openeye Name: 7-(1,4-diazepane-1-carbonyl)-2-(p-tolyl)-1-(pyridine-4-carbonyl)-3,5-dihydro-2H-1,5-benzodiazepin-4-one CAS Name: 7-[1,4-diazepan-1-yl(oxo)methyl]-2-(4-methylphenyl)-1-[oxo(pyridin-4-yl)methyl]-3,5-dihydro-2H-1,5-benzodiazepin-4-one IUPAC Name: 7-(1,4-diazepane-1-carbonyl)-2-(4-methylphenyl)-1-(pyridine-4-carbonyl)-3,5-dihydro-2H-1,5-benzodiazepin-4-one Traditional Name: 7-(1,4-diazepane-1-carbonyl)-1-isonicotinoyl-2-(p-tolyl)-3,5-dihydro-2H-1,5-benzodiazepin-4-one Formula: C28H29N5O3 MolecularWeight: 483.56156

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2CC(=O)NC3=C(N2C(=O)C4=CC=NC=C4)C=CC(=C3)C(=O)N5CCCNCC5

Isomeric SMILES

CC1=CC=C(C=C1)C2CC(=O)NC3=C(N2C(=O)C4=CC=NC=C4)C=CC(=C3)C(=O)N5CCCNCC5

InChI

InChI=1S/C28H29N5O3/c1-19-3-5-20(6-4-19)25-18-26(34)31-23-17-22(27(35)32-15-2-11-29-14-16-32)7-8-24(23)33(25)28(36)21-9-12-30-13-10-21/h3-10,12-13,17,25,29H,2,11,14-16,18H2,1H3,(H,31,34)