(2R)-2-(1-butyl-5-piperidin-1-ylsulfonyl-benzimidazol-2-yl)sulfanyl-N-(4-methylphenyl)propanamide

Systemtic Name: (2R)-2-(1-butyl-5-piperidin-1-ylsulfonyl-benzimidazol-2-yl)sulfanyl-N-(4-methylphenyl)propanamide Openeye Name: (2R)-2-[1-butyl-5-(1-piperidylsulfonyl)benzimidazol-2-yl]sulfanyl-N-(p-tolyl)propanamide CAS Name: (2R)-2-[[1-butyl-5-(1-piperidinylsulfonyl)-2-benzimidazolyl]thio]-N-(4-methylphenyl)propanamide IUPAC Name: (2R)-2-(1-butyl-5-piperidin-1-ylsulfonylbenzimidazol-2-yl)sulfanyl-N-(4-methylphenyl)propanamide Traditional Name: (2R)-2-[(1-butyl-5-piperidinosulfonyl-benzimidazol-2-yl)thio]-N-(p-tolyl)propionamide Formula: C26H34N4O3S2 MolecularWeight: 514.70316

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1SC(C)C(=O)NC4=CC=C(C=C4)C

Isomeric SMILES

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1S[C@H](C)C(=O)NC4=CC=C(C=C4)C

InChI

InChI=1S/C26H34N4O3S2/c1-4-5-17-30-24-14-13-22(35(32,33)29-15-7-6-8-16-29)18-23(24)28-26(30)34-20(3)25(31)27-21-11-9-19(2)10-12-21/h9-14,18,20H,4-8,15-17H2,1-3H3,(H,27,31)/t20-/m1/s1