2-[(2R)-1-(4-methoxyphenyl)-1-oxidanylidene-propan-2-yl]sulfanyl-1-propyl-benzimidazole-5-sulfonamide

Systemtic Name: 2-[(2R)-1-(4-methoxyphenyl)-1-oxidanylidene-propan-2-yl]sulfanyl-1-propyl-benzimidazole-5-sulfonamide Openeye Name: 2-[(1R)-2-(4-methoxyphenyl)-1-methyl-2-oxo-ethyl]sulfanyl-1-propyl-benzimidazole-5-sulfonamide CAS Name: 2-[[(2R)-1-(4-methoxyphenyl)-1-oxopropan-2-yl]thio]-1-propyl-5-benzimidazolesulfonamide IUPAC Name: 2-[(2R)-1-(4-methoxyphenyl)-1-oxopropan-2-yl]sulfanyl-1-propylbenzimidazole-5-sulfonamide Traditional Name: 2-[[(1R)-2-keto-2-(4-methoxyphenyl)-1-methyl-ethyl]thio]-1-propyl-benzimidazole-5-sulfonamide Formula: C20H23N3O4S2 MolecularWeight: 433.54432

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SC(C)C(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1S[C@H](C)C(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C20H23N3O4S2/c1-4-11-23-18-10-9-16(29(21,25)26)12-17(18)22-20(23)28-13(2)19(24)14-5-7-15(27-3)8-6-14/h5-10,12-13H,4,11H2,1-3H3,(H2,21,25,26)/t13-/m1/s1