2-[(6-methoxy-1H-benzimidazol-2-yl)sulfanyl]-N-(3-pyrrolidin-1-ylsulfonylphenyl)ethanamide

Systemtic Name: 2-[(6-methoxy-1H-benzimidazol-2-yl)sulfanyl]-N-(3-pyrrolidin-1-ylsulfonylphenyl)ethanamide Openeye Name: 2-[(6-methoxy-1H-benzimidazol-2-yl)sulfanyl]-N-(3-pyrrolidin-1-ylsulfonylphenyl)acetamide CAS Name: 2-[(6-methoxy-1H-benzimidazol-2-yl)thio]-N-[3-(1-pyrrolidinylsulfonyl)phenyl]acetamide IUPAC Name: 2-[(6-methoxy-1H-benzimidazol-2-yl)sulfanyl]-N-(3-pyrrolidin-1-ylsulfonylphenyl)acetamide Traditional Name: 2-[(6-methoxy-1H-benzimidazol-2-yl)thio]-N-(3-pyrrolidinosulfonylphenyl)acetamide Formula: C20H22N4O4S2 MolecularWeight: 446.54308

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(N2)SCC(=O)NC3=CC(=CC=C3)S(=O)(=O)N4CCCC4

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(N2)SCC(=O)NC3=CC(=CC=C3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C20H22N4O4S2/c1-28-15-7-8-17-18(12-15)23-20(22-17)29-13-19(25)21-14-5-4-6-16(11-14)30(26,27)24-9-2-3-10-24/h4-8,11-12H,2-3,9-10,13H2,1H3,(H,21,25)(H,22,23)