N-(2-azanyl-2-oxidanylidene-1-phenyl-ethyl)-2-[4-[[2-(3-oxidanylpropyl)-1H-benzimidazol-4-yl]methyl]phenyl]cyclohexane-1-carboxamide

Systemtic Name: N-(2-azanyl-2-oxidanylidene-1-phenyl-ethyl)-2-[4-[[2-(3-oxidanylpropyl)-1H-benzimidazol-4-yl]methyl]phenyl]cyclohexane-1-carboxamide Openeye Name: N-(2-amino-2-oxo-1-phenyl-ethyl)-2-[4-[[2-(3-hydroxypropyl)-1H-benzimidazol-4-yl]methyl]phenyl]cyclohexanecarboxamide CAS Name: N-(2-amino-2-oxo-1-phenylethyl)-2-[4-[[2-(3-hydroxypropyl)-1H-benzimidazol-4-yl]methyl]phenyl]-1-cyclohexanecarboxamide IUPAC Name: N-(2-amino-2-oxo-1-phenylethyl)-2-[4-[[2-(3-hydroxypropyl)-1H-benzimidazol-4-yl]methyl]phenyl]cyclohexane-1-carboxamide Traditional Name: N-(2-amino-2-keto-1-phenyl-ethyl)-2-[4-[[2-(3-hydroxypropyl)-1H-benzimidazol-4-yl]methyl]phenyl]cyclohexanecarboxamide Formula: C32H36N4O3 MolecularWeight: 524.65324

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)C2=CC=C(C=C2)CC3=C4C(=CC=C3)NC(=N4)CCCO)C(=O)NC(C5=CC=CC=C5)C(=O)N

Isomeric SMILES

C1CCC(C(C1)C2=CC=C(C=C2)CC3=C4C(=CC=C3)NC(=N4)CCCO)C(=O)NC(C5=CC=CC=C5)C(=O)N

InChI

InChI=1S/C32H36N4O3/c33-31(38)30(23-8-2-1-3-9-23)36-32(39)26-12-5-4-11-25(26)22-17-15-21(16-18-22)20-24-10-6-13-27-29(24)35-28(34-27)14-7-19-37/h1-3,6,8-10,13,15-18,25-26,30,37H,4-5,7,11-12,14,19-20H2,(H2,33,38)(H,34,35)(H,36,39)