3-(1-methyl-5-piperidin-1-ylsulfonyl-benzimidazol-2-yl)-N-(4-methylsulfanylphenyl)propanamide

Systemtic Name: 3-(1-methyl-5-piperidin-1-ylsulfonyl-benzimidazol-2-yl)-N-(4-methylsulfanylphenyl)propanamide Openeye Name: 3-[1-methyl-5-(1-piperidylsulfonyl)benzimidazol-2-yl]-N-(4-methylsulfanylphenyl)propanamide CAS Name: 3-[1-methyl-5-(1-piperidinylsulfonyl)-2-benzimidazolyl]-N-[4-(methylthio)phenyl]propanamide IUPAC Name: 3-(1-methyl-5-piperidin-1-ylsulfonylbenzimidazol-2-yl)-N-(4-methylsulfanylphenyl)propanamide Traditional Name: 3-(1-methyl-5-piperidinosulfonyl-benzimidazol-2-yl)-N-[4-(methylthio)phenyl]propionamide Formula: C23H28N4O3S2 MolecularWeight: 472.62342

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1CCC(=O)NC4=CC=C(C=C4)SC

Isomeric SMILES

CN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1CCC(=O)NC4=CC=C(C=C4)SC

InChI

InChI=1S/C23H28N4O3S2/c1-26-21-11-10-19(32(29,30)27-14-4-3-5-15-27)16-20(21)25-22(26)12-13-23(28)24-17-6-8-18(31-2)9-7-17/h6-11,16H,3-5,12-15H2,1-2H3,(H,24,28)