4-[(4-bromophenyl)-(2-chlorophenyl)methyl]-N-(cyclohexylmethyl)piperazine-1-carboxamide

Systemtic Name: 4-[(4-bromophenyl)-(2-chlorophenyl)methyl]-N-(cyclohexylmethyl)piperazine-1-carboxamide Openeye Name: 4-[(4-bromophenyl)-(2-chlorophenyl)methyl]-N-(cyclohexylmethyl)piperazine-1-carboxamide CAS Name: 4-[(4-bromophenyl)-(2-chlorophenyl)methyl]-N-(cyclohexylmethyl)-1-piperazinecarboxamide IUPAC Name: 4-[(4-bromophenyl)-(2-chlorophenyl)methyl]-N-(cyclohexylmethyl)piperazine-1-carboxamide Traditional Name: 4-[(4-bromophenyl)-(2-chlorophenyl)methyl]-N-(cyclohexylmethyl)piperazine-1-carboxamide Formula: C25H31BrClN3O MolecularWeight: 504.89014

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CNC(=O)N2CCN(CC2)C(C3=CC=C(C=C3)Br)C4=CC=CC=C4Cl

Isomeric SMILES

C1CCC(CC1)CNC(=O)N2CCN(CC2)C(C3=CC=C(C=C3)Br)C4=CC=CC=C4Cl

InChI

InChI=1S/C25H31BrClN3O/c26-21-12-10-20(11-13-21)24(22-8-4-5-9-23(22)27)29-14-16-30(17-15-29)25(31)28-18-19-6-2-1-3-7-19/h4-5,8-13,19,24H,1-3,6-7,14-18H2,(H,28,31)