N-[(1R)-1-(4-fluorophenyl)ethyl]-6-(2-methoxyethanoylamino)-3-phenethyl-benzimidazole-4-carboxamide

Systemtic Name: N-[(1R)-1-(4-fluorophenyl)ethyl]-6-(2-methoxyethanoylamino)-3-phenethyl-benzimidazole-4-carboxamide Openeye Name: N-[(1R)-1-(4-fluorophenyl)ethyl]-6-[(2-methoxyacetyl)amino]-3-phenethyl-benzimidazole-4-carboxamide CAS Name: N-[(1R)-1-(4-fluorophenyl)ethyl]-6-[(2-methoxy-1-oxoethyl)amino]-3-phenethyl-4-benzimidazolecarboxamide IUPAC Name: N-[(1R)-1-(4-fluorophenyl)ethyl]-6-[(2-methoxyacetyl)amino]-3-phenethylbenzimidazole-4-carboxamide Traditional Name: N-[(1R)-1-(4-fluorophenyl)ethyl]-6-[(2-methoxyacetyl)amino]-3-phenethyl-benzimidazole-4-carboxamide Formula: C27H27FN4O3 MolecularWeight: 474.526683

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)F)NC(=O)C2=CC(=CC3=C2N(C=N3)CCC4=CC=CC=C4)NC(=O)COC

Isomeric SMILES

C[C@H](C1=CC=C(C=C1)F)NC(=O)C2=CC(=CC3=C2N(C=N3)CCC4=CC=CC=C4)NC(=O)COC

InChI

InChI=1S/C27H27FN4O3/c1-18(20-8-10-21(28)11-9-20)30-27(34)23-14-22(31-25(33)16-35-2)15-24-26(23)32(17-29-24)13-12-19-6-4-3-5-7-19/h3-11,14-15,17-18H,12-13,16H2,1-2H3,(H,30,34)(H,31,33)/t18-/m1/s1