1-butyl-2-[(1S)-2-oxidanylidene-1-phenyl-2-piperidin-1-yl-ethyl]sulfanyl-benzimidazole-5-sulfonamide

Systemtic Name: 1-butyl-2-[(1S)-2-oxidanylidene-1-phenyl-2-piperidin-1-yl-ethyl]sulfanyl-benzimidazole-5-sulfonamide Openeye Name: 1-butyl-2-[(1S)-2-oxo-1-phenyl-2-(1-piperidyl)ethyl]sulfanyl-benzimidazole-5-sulfonamide CAS Name: 1-butyl-2-[[(1S)-2-oxo-1-phenyl-2-(1-piperidinyl)ethyl]thio]-5-benzimidazolesulfonamide IUPAC Name: 1-butyl-2-[(1S)-2-oxo-1-phenyl-2-piperidin-1-ylethyl]sulfanylbenzimidazole-5-sulfonamide Traditional Name: 1-butyl-2-[[(1S)-2-keto-1-phenyl-2-piperidino-ethyl]thio]benzimidazole-5-sulfonamide Formula: C24H30N4O3S2 MolecularWeight: 486.65

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1SC(C3=CC=CC=C3)C(=O)N4CCCCC4

Isomeric SMILES

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1S[C@@H](C3=CC=CC=C3)C(=O)N4CCCCC4

InChI

InChI=1S/C24H30N4O3S2/c1-2-3-16-28-21-13-12-19(33(25,30)31)17-20(21)26-24(28)32-22(18-10-6-4-7-11-18)23(29)27-14-8-5-9-15-27/h4,6-7,10-13,17,22H,2-3,5,8-9,14-16H2,1H3,(H2,25,30,31)/t22-/m0/s1