4-[4-azanyl-2-[methyl-(phenylmethyl)carbamoyl]phenyl]-N-(3-methylphenyl)piperazine-1-carboxamide

Systemtic Name: 4-[4-azanyl-2-[methyl-(phenylmethyl)carbamoyl]phenyl]-N-(3-methylphenyl)piperazine-1-carboxamide Openeye Name: 4-[4-amino-2-[benzyl(methyl)carbamoyl]phenyl]-N-(m-tolyl)piperazine-1-carboxamide CAS Name: 4-[4-amino-2-[[methyl-(phenylmethyl)amino]-oxomethyl]phenyl]-N-(3-methylphenyl)-1-piperazinecarboxamide IUPAC Name: 4-[4-amino-2-[benzyl(methyl)carbamoyl]phenyl]-N-(3-methylphenyl)piperazine-1-carboxamide Traditional Name: 4-[4-amino-2-[benzyl(methyl)carbamoyl]phenyl]-N-(m-tolyl)piperazine-1-carboxamide Formula: C27H31N5O2 MolecularWeight: 457.56734

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)N2CCN(CC2)C3=C(C=C(C=C3)N)C(=O)N(C)CC4=CC=CC=C4

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)N2CCN(CC2)C3=C(C=C(C=C3)N)C(=O)N(C)CC4=CC=CC=C4

InChI

InChI=1S/C27H31N5O2/c1-20-7-6-10-23(17-20)29-27(34)32-15-13-31(14-16-32)25-12-11-22(28)18-24(25)26(33)30(2)19-21-8-4-3-5-9-21/h3-12,17-18H,13-16,19,28H2,1-2H3,(H,29,34)