N-[1-(2,4-dimethylphenyl)ethyl]-1-(4-methoxyphenyl)sulfonyl-piperidine-3-carboxamide

Systemtic Name: N-[1-(2,4-dimethylphenyl)ethyl]-1-(4-methoxyphenyl)sulfonyl-piperidine-3-carboxamide Openeye Name: N-[1-(2,4-dimethylphenyl)ethyl]-1-(4-methoxyphenyl)sulfonyl-piperidine-3-carboxamide CAS Name: N-[1-(2,4-dimethylphenyl)ethyl]-1-(4-methoxyphenyl)sulfonyl-3-piperidinecarboxamide IUPAC Name: N-[1-(2,4-dimethylphenyl)ethyl]-1-(4-methoxyphenyl)sulfonylpiperidine-3-carboxamide Traditional Name: N-[1-(2,4-dimethylphenyl)ethyl]-1-(4-methoxyphenyl)sulfonyl-nipecotamide Formula: C23H30N2O4S MolecularWeight: 430.5603

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)NC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=C(C=C3)OC)C

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)NC(=O)C2CCCN(C2)S(=O)(=O)C3=CC=C(C=C3)OC)C

InChI

InChI=1S/C23H30N2O4S/c1-16-7-12-22(17(2)14-16)18(3)24-23(26)19-6-5-13-25(15-19)30(27,28)21-10-8-20(29-4)9-11-21/h7-12,14,18-19H,5-6,13,15H2,1-4H3,(H,24,26)