N-(2-azanyl-2-oxidanylidene-1-phenyl-ethyl)-2-[4-[(2-piperazin-1-ylbenzimidazol-1-yl)methyl]phenyl]cyclohexane-1-carboxamide

Systemtic Name: N-(2-azanyl-2-oxidanylidene-1-phenyl-ethyl)-2-[4-[(2-piperazin-1-ylbenzimidazol-1-yl)methyl]phenyl]cyclohexane-1-carboxamide Openeye Name: N-(2-amino-2-oxo-1-phenyl-ethyl)-2-[4-[(2-piperazin-1-ylbenzimidazol-1-yl)methyl]phenyl]cyclohexanecarboxamide CAS Name: N-(2-amino-2-oxo-1-phenylethyl)-2-[4-[[2-(1-piperazinyl)-1-benzimidazolyl]methyl]phenyl]-1-cyclohexanecarboxamide IUPAC Name: N-(2-amino-2-oxo-1-phenylethyl)-2-[4-[(2-piperazin-1-ylbenzimidazol-1-yl)methyl]phenyl]cyclohexane-1-carboxamide Traditional Name: N-(2-amino-2-keto-1-phenyl-ethyl)-2-[4-[(2-piperazinobenzimidazol-1-yl)methyl]phenyl]cyclohexanecarboxamide Formula: C33H38N6O2 MolecularWeight: 550.69382

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)C2=CC=C(C=C2)CN3C4=CC=CC=C4N=C3N5CCNCC5)C(=O)NC(C6=CC=CC=C6)C(=O)N

Isomeric SMILES

C1CCC(C(C1)C2=CC=C(C=C2)CN3C4=CC=CC=C4N=C3N5CCNCC5)C(=O)NC(C6=CC=CC=C6)C(=O)N

InChI

InChI=1S/C33H38N6O2/c34-31(40)30(25-8-2-1-3-9-25)37-32(41)27-11-5-4-10-26(27)24-16-14-23(15-17-24)22-39-29-13-7-6-12-28(29)36-33(39)38-20-18-35-19-21-38/h1-3,6-9,12-17,26-27,30,35H,4-5,10-11,18-22H2,(H2,34,40)(H,37,41)