4-[(cyanoamino)-[(2-methylphenyl)amino]methyl]-2-phenyl-N-(2-propan-2-ylphenyl)piperazine-1-carboxamide

Systemtic Name: 4-[(cyanoamino)-[(2-methylphenyl)amino]methyl]-2-phenyl-N-(2-propan-2-ylphenyl)piperazine-1-carboxamide Openeye Name: 4-[(cyanoamino)-(2-methylanilino)methyl]-N-(2-isopropylphenyl)-2-phenyl-piperazine-1-carboxamide CAS Name: 4-[(cyanoamino)-(2-methylanilino)methyl]-2-phenyl-N-(2-propan-2-ylphenyl)-1-piperazinecarboxamide IUPAC Name: 4-[(cyanoamino)-(2-methylanilino)methyl]-2-phenyl-N-(2-propan-2-ylphenyl)piperazine-1-carboxamide Traditional Name: 4-[(cyanoamino)-(o-toluidino)methyl]-N-o-cumenyl-2-phenyl-piperazine-1-carboxamide Formula: C29H34N6O MolecularWeight: 482.61986

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(NC#N)N2CCN(C(C2)C3=CC=CC=C3)C(=O)NC4=CC=CC=C4C(C)C

Isomeric SMILES

CC1=CC=CC=C1NC(NC#N)N2CCN(C(C2)C3=CC=CC=C3)C(=O)NC4=CC=CC=C4C(C)C

InChI

InChI=1S/C29H34N6O/c1-21(2)24-14-8-10-16-26(24)33-29(36)35-18-17-34(19-27(35)23-12-5-4-6-13-23)28(31-20-30)32-25-15-9-7-11-22(25)3/h4-16,21,27-28,31-32H,17-19H2,1-3H3,(H,33,36)