2-(4-methylphenyl)-7-piperazin-1-ylcarbonyl-1,2,3,5-tetrahydro-1,5-benzodiazepin-4-one

Systemtic Name: 2-(4-methylphenyl)-7-piperazin-1-ylcarbonyl-1,2,3,5-tetrahydro-1,5-benzodiazepin-4-one Openeye Name: 7-(piperazine-1-carbonyl)-2-(p-tolyl)-1,2,3,5-tetrahydro-1,5-benzodiazepin-4-one CAS Name: 2-(4-methylphenyl)-7-[oxo(1-piperazinyl)methyl]-1,2,3,5-tetrahydro-1,5-benzodiazepin-4-one IUPAC Name: 2-(4-methylphenyl)-7-(piperazine-1-carbonyl)-1,2,3,5-tetrahydro-1,5-benzodiazepin-4-one Traditional Name: 7-(piperazine-1-carbonyl)-2-(p-tolyl)-1,2,3,5-tetrahydro-1,5-benzodiazepin-4-one Formula: C21H24N4O2 MolecularWeight: 364.44086

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2CC(=O)NC3=C(N2)C=CC(=C3)C(=O)N4CCNCC4

Isomeric SMILES

CC1=CC=C(C=C1)C2CC(=O)NC3=C(N2)C=CC(=C3)C(=O)N4CCNCC4

InChI

InChI=1S/C21H24N4O2/c1-14-2-4-15(5-3-14)18-13-20(26)24-19-12-16(6-7-17(19)23-18)21(27)25-10-8-22-9-11-25/h2-7,12,18,22-23H,8-11,13H2,1H3,(H,24,26)