1-[2-(4-methoxyphenyl)pyrrolidin-1-yl]-2-[2-(methylsulfonylmethyl)benzimidazol-1-yl]ethanone

Systemtic Name: 1-[2-(4-methoxyphenyl)pyrrolidin-1-yl]-2-[2-(methylsulfonylmethyl)benzimidazol-1-yl]ethanone Openeye Name: 1-[2-(4-methoxyphenyl)pyrrolidin-1-yl]-2-[2-(methylsulfonylmethyl)benzimidazol-1-yl]ethanone CAS Name: 1-[2-(4-methoxyphenyl)-1-pyrrolidinyl]-2-[2-(methylsulfonylmethyl)-1-benzimidazolyl]ethanone IUPAC Name: 1-[2-(4-methoxyphenyl)pyrrolidin-1-yl]-2-[2-(methylsulfonylmethyl)benzimidazol-1-yl]ethanone Traditional Name: 2-[2-(mesylmethyl)benzimidazol-1-yl]-1-[2-(4-methoxyphenyl)pyrrolidino]ethanone Formula: C22H25N3O4S MolecularWeight: 427.5166

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2CCCN2C(=O)CN3C4=CC=CC=C4N=C3CS(=O)(=O)C

Isomeric SMILES

COC1=CC=C(C=C1)C2CCCN2C(=O)CN3C4=CC=CC=C4N=C3CS(=O)(=O)C

InChI

InChI=1S/C22H25N3O4S/c1-29-17-11-9-16(10-12-17)19-8-5-13-24(19)22(26)14-25-20-7-4-3-6-18(20)23-21(25)15-30(2,27)28/h3-4,6-7,9-12,19H,5,8,13-15H2,1-2H3