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

Systemtic Name: 2-(4-methylphenyl)-1-(2-phenoxypropanoyl)-7-piperazin-1-ylcarbonyl-3,5-dihydro-2H-1,5-benzodiazepin-4-one Openeye Name: 1-(2-phenoxypropanoyl)-7-(piperazine-1-carbonyl)-2-(p-tolyl)-3,5-dihydro-2H-1,5-benzodiazepin-4-one CAS Name: 2-(4-methylphenyl)-1-(1-oxo-2-phenoxypropyl)-7-[oxo(1-piperazinyl)methyl]-3,5-dihydro-2H-1,5-benzodiazepin-4-one IUPAC Name: 2-(4-methylphenyl)-1-(2-phenoxypropanoyl)-7-(piperazine-1-carbonyl)-3,5-dihydro-2H-1,5-benzodiazepin-4-one Traditional Name: 1-(2-phenoxypropanoyl)-7-(piperazine-1-carbonyl)-2-(p-tolyl)-3,5-dihydro-2H-1,5-benzodiazepin-4-one Formula: C30H32N4O4 MolecularWeight: 512.59948

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2CC(=O)NC3=C(N2C(=O)C(C)OC4=CC=CC=C4)C=CC(=C3)C(=O)N5CCNCC5

Isomeric SMILES

CC1=CC=C(C=C1)C2CC(=O)NC3=C(N2C(=O)C(C)OC4=CC=CC=C4)C=CC(=C3)C(=O)N5CCNCC5

InChI

InChI=1S/C30H32N4O4/c1-20-8-10-22(11-9-20)27-19-28(35)32-25-18-23(30(37)33-16-14-31-15-17-33)12-13-26(25)34(27)29(36)21(2)38-24-6-4-3-5-7-24/h3-13,18,21,27,31H,14-17,19H2,1-2H3,(H,32,35)