N-[3-[[(2-azanylcyclohexyl)-cyclopropylcarbonyl-amino]methyl]-4-chloranyl-phenyl]-3-chloranyl-benzamide

Systemtic Name: N-[3-[[(2-azanylcyclohexyl)-cyclopropylcarbonyl-amino]methyl]-4-chloranyl-phenyl]-3-chloranyl-benzamide Openeye Name: N-[3-[[(2-aminocyclohexyl)-(cyclopropanecarbonyl)amino]methyl]-4-chloro-phenyl]-3-chloro-benzamide CAS Name: N-[3-[[(2-aminocyclohexyl)-[cyclopropyl(oxo)methyl]amino]methyl]-4-chlorophenyl]-3-chlorobenzamide IUPAC Name: N-[3-[[(2-aminocyclohexyl)-(cyclopropanecarbonyl)amino]methyl]-4-chlorophenyl]-3-chlorobenzamide Traditional Name: N-[3-[[(2-aminocyclohexyl)-(cyclopropanecarbonyl)amino]methyl]-4-chloro-phenyl]-3-chloro-benzamide Formula: C24H27Cl2N3O2 MolecularWeight: 460.39608

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)N)N(CC2=C(C=CC(=C2)NC(=O)C3=CC(=CC=C3)Cl)Cl)C(=O)C4CC4

Isomeric SMILES

C1CCC(C(C1)N)N(CC2=C(C=CC(=C2)NC(=O)C3=CC(=CC=C3)Cl)Cl)C(=O)C4CC4

InChI

InChI=1S/C24H27Cl2N3O2/c25-18-5-3-4-16(12-18)23(30)28-19-10-11-20(26)17(13-19)14-29(24(31)15-8-9-15)22-7-2-1-6-21(22)27/h3-5,10-13,15,21-22H,1-2,6-9,14,27H2,(H,28,30)