N-[1-(3-azanyl-3-oxidanylidene-propyl)-5-[cyclohexylcarbonyl(methyl)amino]benzimidazol-2-yl]-4-ethanoyl-benzamide

Systemtic Name: N-[1-(3-azanyl-3-oxidanylidene-propyl)-5-[cyclohexylcarbonyl(methyl)amino]benzimidazol-2-yl]-4-ethanoyl-benzamide Openeye Name: 4-acetyl-N-[1-(3-amino-3-oxo-propyl)-5-[cyclohexanecarbonyl(methyl)amino]benzimidazol-2-yl]benzamide CAS Name: 4-acetyl-N-[1-(3-amino-3-oxopropyl)-5-[[cyclohexyl(oxo)methyl]-methylamino]-2-benzimidazolyl]benzamide IUPAC Name: 4-acetyl-N-[1-(3-amino-3-oxopropyl)-5-[cyclohexanecarbonyl(methyl)amino]benzimidazol-2-yl]benzamide Traditional Name: 4-acetyl-N-[1-(3-amino-3-keto-propyl)-5-[cyclohexanecarbonyl(methyl)amino]benzimidazol-2-yl]benzamide Formula: C27H31N5O4 MolecularWeight: 489.56614

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)C(=O)NC2=NC3=C(N2CCC(=O)N)C=CC(=C3)N(C)C(=O)C4CCCCC4

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)C(=O)NC2=NC3=C(N2CCC(=O)N)C=CC(=C3)N(C)C(=O)C4CCCCC4

InChI

InChI=1S/C27H31N5O4/c1-17(33)18-8-10-19(11-9-18)25(35)30-27-29-22-16-21(12-13-23(22)32(27)15-14-24(28)34)31(2)26(36)20-6-4-3-5-7-20/h8-13,16,20H,3-7,14-15H2,1-2H3,(H2,28,34)(H,29,30,35)