ethyl 4-[2-[2-(1H-benzimidazol-2-yl)ethylcarbamoyl]pyrrolidin-1-yl]sulfonyl-1-methyl-pyrrole-2-carboxylate

Systemtic Name: ethyl 4-[2-[2-(1H-benzimidazol-2-yl)ethylcarbamoyl]pyrrolidin-1-yl]sulfonyl-1-methyl-pyrrole-2-carboxylate Openeye Name: ethyl 4-[2-[2-(1H-benzimidazol-2-yl)ethylcarbamoyl]pyrrolidin-1-yl]sulfonyl-1-methyl-pyrrole-2-carboxylate CAS Name: 4-[[2-[[2-(1H-benzimidazol-2-yl)ethylamino]-oxomethyl]-1-pyrrolidinyl]sulfonyl]-1-methyl-2-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-[2-(1H-benzimidazol-2-yl)ethylcarbamoyl]pyrrolidin-1-yl]sulfonyl-1-methylpyrrole-2-carboxylate Traditional Name: 4-[2-[2-(1H-benzimidazol-2-yl)ethylcarbamoyl]pyrrolidino]sulfonyl-1-methyl-pyrrole-2-carboxylic acid ethyl ester Formula: C22H27N5O5S MolecularWeight: 473.54528

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CN1C)S(=O)(=O)N2CCCC2C(=O)NCCC3=NC4=CC=CC=C4N3

Isomeric SMILES

CCOC(=O)C1=CC(=CN1C)S(=O)(=O)N2CCCC2C(=O)NCCC3=NC4=CC=CC=C4N3

InChI

InChI=1S/C22H27N5O5S/c1-3-32-22(29)19-13-15(14-26(19)2)33(30,31)27-12-6-9-18(27)21(28)23-11-10-20-24-16-7-4-5-8-17(16)25-20/h4-5,7-8,13-14,18H,3,6,9-12H2,1-2H3,(H,23,28)(H,24,25)