4-(2-azanyl-6-phenoxy-benzimidazol-1-yl)-N-cyclohexyl-N-ethyl-hexanamide; 2,2,2-tris(fluoranyl)ethanoic acid

Systemtic Name: 4-(2-azanyl-6-phenoxy-benzimidazol-1-yl)-N-cyclohexyl-N-ethyl-hexanamide; 2,2,2-tris(fluoranyl)ethanoic acid Openeye Name: 4-(2-amino-6-phenoxy-benzimidazol-1-yl)-N-cyclohexyl-N-ethyl-hexanamide; 2,2,2-trifluoroacetic acid CAS Name: 4-(2-amino-6-phenoxy-1-benzimidazolyl)-N-cyclohexyl-N-ethylhexanamide; 2,2,2-trifluoroacetic acid IUPAC Name: 4-(2-amino-6-phenoxybenzimidazol-1-yl)-N-cyclohexyl-N-ethylhexanamide; 2,2,2-trifluoroacetic acid Traditional Name: 4-(2-amino-6-phenoxy-benzimidazol-1-yl)-N-cyclohexyl-N-ethyl-hexanamide; 2,2,2-trifluoroacetic acid Formula: C29H37F3N4O4 MolecularWeight: 562.62369

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CCC(=O)N(CC)C1CCCCC1)N2C3=C(C=CC(=C3)OC4=CC=CC=C4)N=C2N.C(=O)(C(F)(F)F)O

Isomeric SMILES

CCC(CCC(=O)N(CC)C1CCCCC1)N2C3=C(C=CC(=C3)OC4=CC=CC=C4)N=C2N.C(=O)(C(F)(F)F)O

InChI

InChI=1S/C27H36N4O2.C2HF3O2/c1-3-20(15-18-26(32)30(4-2)21-11-7-5-8-12-21)31-25-19-23(16-17-24(25)29-27(31)28)33-22-13-9-6-10-14-22;3-2(4,5)1(6)7/h6,9-10,13-14,16-17,19-21H,3-5,7-8,11-12,15,18H2,1-2H3,(H2,28,29);(H,6,7)