N-(3-acetamidophenyl)-1-(3,4-dimethylphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-(3-acetamidophenyl)-1-(3,4-dimethylphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-(3-acetamidophenyl)-1-(3,4-dimethylphenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-(3-acetamidophenyl)-1-(3,4-dimethylphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-(3-acetamidophenyl)-1-(3,4-dimethylphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-(3-acetamidophenyl)-1-(3,4-dimethylphenyl)sulfonyl-isonipecotamide Formula: C22H27N3O4S MolecularWeight: 429.53248

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC(=CC=C3)NC(=O)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC(=CC=C3)NC(=O)C)C

InChI

InChI=1S/C22H27N3O4S/c1-15-7-8-21(13-16(15)2)30(28,29)25-11-9-18(10-12-25)22(27)24-20-6-4-5-19(14-20)23-17(3)26/h4-8,13-14,18H,9-12H2,1-3H3,(H,23,26)(H,24,27)