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

Systemtic Name: methyl (2S)-1-[6-(dimethylsulfamoylamino)-3-methyl-2-(2-methylpropyl)benzimidazol-4-yl]carbonylpyrrolidine-2-carboxylate Openeye Name: methyl (2S)-1-[6-(dimethylsulfamoylamino)-2-isobutyl-3-methyl-benzimidazole-4-carbonyl]pyrrolidine-2-carboxylate CAS Name: (2S)-1-[[6-(dimethylsulfamoylamino)-3-methyl-2-(2-methylpropyl)-4-benzimidazolyl]-oxomethyl]-2-pyrrolidinecarboxylic acid methyl ester IUPAC Name: methyl (2S)-1-[6-(dimethylsulfamoylamino)-3-methyl-2-(2-methylpropyl)benzimidazole-4-carbonyl]pyrrolidine-2-carboxylate Traditional Name: (2S)-1-[6-(dimethylsulfamoylamino)-2-isobutyl-3-methyl-benzimidazole-4-carbonyl]pyrrolidine-2-carboxylic acid methyl ester Formula: C21H31N5O5S MolecularWeight: 465.56634

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=NC2=C(N1C)C(=CC(=C2)NS(=O)(=O)N(C)C)C(=O)N3CCCC3C(=O)OC

Isomeric SMILES

CC(C)CC1=NC2=C(N1C)C(=CC(=C2)NS(=O)(=O)N(C)C)C(=O)N3CCC[C@H]3C(=O)OC

InChI

InChI=1S/C21H31N5O5S/c1-13(2)10-18-22-16-12-14(23-32(29,30)24(3)4)11-15(19(16)25(18)5)20(27)26-9-7-8-17(26)21(28)31-6/h11-13,17,23H,7-10H2,1-6H3/t17-/m0/s1