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

Systemtic Name: 2-[(2R)-1-(4-methylpiperidin-1-yl)-1-oxidanylidene-propan-2-yl]sulfanyl-1-propyl-benzimidazole-5-sulfonamide Openeye Name: 2-[(1R)-1-methyl-2-(4-methyl-1-piperidyl)-2-oxo-ethyl]sulfanyl-1-propyl-benzimidazole-5-sulfonamide CAS Name: 2-[[(2R)-1-(4-methyl-1-piperidinyl)-1-oxopropan-2-yl]thio]-1-propyl-5-benzimidazolesulfonamide IUPAC Name: 2-[(2R)-1-(4-methylpiperidin-1-yl)-1-oxopropan-2-yl]sulfanyl-1-propylbenzimidazole-5-sulfonamide Traditional Name: 2-[[(1R)-2-keto-1-methyl-2-(4-methylpiperidino)ethyl]thio]-1-propyl-benzimidazole-5-sulfonamide Formula: C19H28N4O3S2 MolecularWeight: 424.58062

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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)N3CCC(CC3)C

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1S[C@H](C)C(=O)N3CCC(CC3)C

InChI

InChI=1S/C19H28N4O3S2/c1-4-9-23-17-6-5-15(28(20,25)26)12-16(17)21-19(23)27-14(3)18(24)22-10-7-13(2)8-11-22/h5-6,12-14H,4,7-11H2,1-3H3,(H2,20,25,26)/t14-/m1/s1