N-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)-2-(1-methylbenzimidazol-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)-2-(1-methylbenzimidazol-2-yl)sulfanyl-ethanamide Openeye Name: N-(4-ethoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)-2-(1-methylbenzimidazol-2-yl)sulfanyl-acetamide CAS Name: N-[4-ethoxy-3-(1-pyrrolidinylsulfonyl)phenyl]-2-[(1-methyl-2-benzimidazolyl)thio]acetamide IUPAC Name: N-(4-ethoxy-3-pyrrolidin-1-ylsulfonylphenyl)-2-(1-methylbenzimidazol-2-yl)sulfanylacetamide Traditional Name: N-(4-ethoxy-3-pyrrolidinosulfonyl-phenyl)-2-[(1-methylbenzimidazol-2-yl)thio]acetamide Formula: C22H26N4O4S2 MolecularWeight: 474.59624

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3N2C)S(=O)(=O)N4CCCC4

Isomeric SMILES

CCOC1=C(C=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3N2C)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C22H26N4O4S2/c1-3-30-19-11-10-16(14-20(19)32(28,29)26-12-6-7-13-26)23-21(27)15-31-22-24-17-8-4-5-9-18(17)25(22)2/h4-5,8-11,14H,3,6-7,12-13,15H2,1-2H3,(H,23,27)