methyl (2S)-1-[2-cyclobutyl-6-(2-methoxyethanoylamino)-3-methyl-benzimidazol-4-yl]carbonylpyrrolidine-2-carboxylate

Systemtic Name: methyl (2S)-1-[2-cyclobutyl-6-(2-methoxyethanoylamino)-3-methyl-benzimidazol-4-yl]carbonylpyrrolidine-2-carboxylate Openeye Name: methyl (2S)-1-[2-cyclobutyl-6-[(2-methoxyacetyl)amino]-3-methyl-benzimidazole-4-carbonyl]pyrrolidine-2-carboxylate CAS Name: (2S)-1-[[2-cyclobutyl-6-[(2-methoxy-1-oxoethyl)amino]-3-methyl-4-benzimidazolyl]-oxomethyl]-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl (2S)-1-[2-cyclobutyl-6-[(2-methoxyacetyl)amino]-3-methylbenzimidazole-4-carbonyl]pyrrolidine-2-carboxylate Traditional Name: (2S)-1-[2-cyclobutyl-6-[(2-methoxyacetyl)amino]-3-methyl-benzimidazole-4-carbonyl]pyrrolidine-2-carboxylic acid methyl ester Formula: C22H28N4O5 MolecularWeight: 428.48152

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NC2=C1C(=CC(=C2)NC(=O)COC)C(=O)N3CCCC3C(=O)OC)C4CCC4

Isomeric SMILES

CN1C(=NC2=C1C(=CC(=C2)NC(=O)COC)C(=O)N3CCC[C@H]3C(=O)OC)C4CCC4

InChI

InChI=1S/C22H28N4O5/c1-25-19-15(21(28)26-9-5-8-17(26)22(29)31-3)10-14(23-18(27)12-30-2)11-16(19)24-20(25)13-6-4-7-13/h10-11,13,17H,4-9,12H2,1-3H3,(H,23,27)/t17-/m0/s1