4-(1H-benzimidazol-2-ylsulfanyl)-N-(3-piperidin-1-ylsulfonylphenyl)butanamide

Systemtic Name: 4-(1H-benzimidazol-2-ylsulfanyl)-N-(3-piperidin-1-ylsulfonylphenyl)butanamide Openeye Name: 4-(1H-benzimidazol-2-ylsulfanyl)-N-[3-(1-piperidylsulfonyl)phenyl]butanamide CAS Name: 4-(1H-benzimidazol-2-ylthio)-N-[3-(1-piperidinylsulfonyl)phenyl]butanamide IUPAC Name: 4-(1H-benzimidazol-2-ylsulfanyl)-N-(3-piperidin-1-ylsulfonylphenyl)butanamide Traditional Name: 4-(1H-benzimidazol-2-ylthio)-N-(3-piperidinosulfonylphenyl)butyramide Formula: C22H26N4O3S2 MolecularWeight: 458.59684

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)CCCSC3=NC4=CC=CC=C4N3

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)CCCSC3=NC4=CC=CC=C4N3

InChI

InChI=1S/C22H26N4O3S2/c27-21(12-7-15-30-22-24-19-10-2-3-11-20(19)25-22)23-17-8-6-9-18(16-17)31(28,29)26-13-4-1-5-14-26/h2-3,6,8-11,16H,1,4-5,7,12-15H2,(H,23,27)(H,24,25)