2-(1-methylbenzimidazol-2-yl)sulfanyl-N-(3-piperidin-1-ylsulfonylphenyl)propanamide

Systemtic Name: 2-(1-methylbenzimidazol-2-yl)sulfanyl-N-(3-piperidin-1-ylsulfonylphenyl)propanamide Openeye Name: 2-(1-methylbenzimidazol-2-yl)sulfanyl-N-[3-(1-piperidylsulfonyl)phenyl]propanamide CAS Name: 2-[(1-methyl-2-benzimidazolyl)thio]-N-[3-(1-piperidinylsulfonyl)phenyl]propanamide IUPAC Name: 2-(1-methylbenzimidazol-2-yl)sulfanyl-N-(3-piperidin-1-ylsulfonylphenyl)propanamide Traditional Name: 2-[(1-methylbenzimidazol-2-yl)thio]-N-(3-piperidinosulfonylphenyl)propionamide Formula: C22H26N4O3S2 MolecularWeight: 458.59684

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=CC=C1)S(=O)(=O)N2CCCCC2)SC3=NC4=CC=CC=C4N3C

Isomeric SMILES

CC(C(=O)NC1=CC(=CC=C1)S(=O)(=O)N2CCCCC2)SC3=NC4=CC=CC=C4N3C

InChI

InChI=1S/C22H26N4O3S2/c1-16(30-22-24-19-11-4-5-12-20(19)25(22)2)21(27)23-17-9-8-10-18(15-17)31(28,29)26-13-6-3-7-14-26/h4-5,8-12,15-16H,3,6-7,13-14H2,1-2H3,(H,23,27)