3-(2-azanylethyl)-1-[(1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl]carbonyl-2-oxidanylidene-N-phenyl-benzimidazole-5-carboxamide

Systemtic Name: 3-(2-azanylethyl)-1-[(1R,2S,5R)-5-methyl-2-propan-2-yl-cyclohexyl]carbonyl-2-oxidanylidene-N-phenyl-benzimidazole-5-carboxamide Openeye Name: 3-(2-aminoethyl)-1-[(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexanecarbonyl]-2-oxo-N-phenyl-benzimidazole-5-carboxamide CAS Name: 3-(2-aminoethyl)-1-[[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl]-oxomethyl]-2-oxo-N-phenyl-5-benzimidazolecarboxamide IUPAC Name: 3-(2-aminoethyl)-1-[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexanecarbonyl]-2-oxo-N-phenylbenzimidazole-5-carboxamide Traditional Name: 3-(2-aminoethyl)-1-[(1R,2S,5R)-2-isopropyl-5-methyl-cyclohexanecarbonyl]-2-keto-N-phenyl-benzimidazole-5-carboxamide Formula: C27H34N4O3 MolecularWeight: 462.58386

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(C1)C(=O)N2C3=C(C=C(C=C3)C(=O)NC4=CC=CC=C4)N(C2=O)CCN)C(C)C

Isomeric SMILES

C[C@@H]1CC[C@H]([C@@H](C1)C(=O)N2C3=C(C=C(C=C3)C(=O)NC4=CC=CC=C4)N(C2=O)CCN)C(C)C

InChI

InChI=1S/C27H34N4O3/c1-17(2)21-11-9-18(3)15-22(21)26(33)31-23-12-10-19(16-24(23)30(14-13-28)27(31)34)25(32)29-20-7-5-4-6-8-20/h4-8,10,12,16-18,21-22H,9,11,13-15,28H2,1-3H3,(H,29,32)/t18-,21+,22-/m1/s1