N-(1H-benzimidazol-2-yl)-1-(2,4,6-trimethylphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(1H-benzimidazol-2-yl)-1-(2,4,6-trimethylphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-(1H-benzimidazol-2-yl)-1-(2,4,6-trimethylphenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-(1H-benzimidazol-2-yl)-1-(2,4,6-trimethylphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-(1H-benzimidazol-2-yl)-1-(2,4,6-trimethylphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-(1H-benzimidazol-2-yl)-1-mesitylsulfonyl-isonipecotamide Formula: C22H26N4O3S MolecularWeight: 426.53184

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCC(CC2)C(=O)NC3=NC4=CC=CC=C4N3)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)N2CCC(CC2)C(=O)NC3=NC4=CC=CC=C4N3)C

InChI

InChI=1S/C22H26N4O3S/c1-14-12-15(2)20(16(3)13-14)30(28,29)26-10-8-17(9-11-26)21(27)25-22-23-18-6-4-5-7-19(18)24-22/h4-7,12-13,17H,8-11H2,1-3H3,(H2,23,24,25,27)