1-(3,4-dimethylphenyl)sulfonyl-N-(5-methylhexan-2-yl)piperidine-4-carboxamide

Systemtic Name: 1-(3,4-dimethylphenyl)sulfonyl-N-(5-methylhexan-2-yl)piperidine-4-carboxamide Openeye Name: N-(1,4-dimethylpentyl)-1-(3,4-dimethylphenyl)sulfonyl-piperidine-4-carboxamide CAS Name: 1-(3,4-dimethylphenyl)sulfonyl-N-(5-methylhexan-2-yl)-4-piperidinecarboxamide IUPAC Name: 1-(3,4-dimethylphenyl)sulfonyl-N-(5-methylhexan-2-yl)piperidine-4-carboxamide Traditional Name: N-(1,4-dimethylpentyl)-1-(3,4-dimethylphenyl)sulfonyl-isonipecotamide Formula: C21H34N2O3S MolecularWeight: 394.57126

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC(C)CCC(C)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC(C)CCC(C)C)C

InChI

InChI=1S/C21H34N2O3S/c1-15(2)6-8-18(5)22-21(24)19-10-12-23(13-11-19)27(25,26)20-9-7-16(3)17(4)14-20/h7,9,14-15,18-19H,6,8,10-13H2,1-5H3,(H,22,24)