N-(1H-benzimidazol-2-yl)-1-(4-ethanoylphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(1H-benzimidazol-2-yl)-1-(4-ethanoylphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: 1-(4-acetylphenyl)sulfonyl-N-(1H-benzimidazol-2-yl)piperidine-4-carboxamide CAS Name: 1-(4-acetylphenyl)sulfonyl-N-(1H-benzimidazol-2-yl)-4-piperidinecarboxamide IUPAC Name: 1-(4-acetylphenyl)sulfonyl-N-(1H-benzimidazol-2-yl)piperidine-4-carboxamide Traditional Name: 1-(4-acetylphenyl)sulfonyl-N-(1H-benzimidazol-2-yl)isonipecotamide Formula: C21H22N4O4S MolecularWeight: 426.48878

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=NC4=CC=CC=C4N3

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=NC4=CC=CC=C4N3

InChI

InChI=1S/C21H22N4O4S/c1-14(26)15-6-8-17(9-7-15)30(28,29)25-12-10-16(11-13-25)20(27)24-21-22-18-4-2-3-5-19(18)23-21/h2-9,16H,10-13H2,1H3,(H2,22,23,24,27)