1-(4-methoxyphenyl)sulfonyl-N-(2-prop-2-enylsulfanylphenyl)piperidine-3-carboxamide

Systemtic Name: 1-(4-methoxyphenyl)sulfonyl-N-(2-prop-2-enylsulfanylphenyl)piperidine-3-carboxamide Openeye Name: N-(2-allylsulfanylphenyl)-1-(4-methoxyphenyl)sulfonyl-piperidine-3-carboxamide CAS Name: 1-(4-methoxyphenyl)sulfonyl-N-[2-(prop-2-enylthio)phenyl]-3-piperidinecarboxamide IUPAC Name: 1-(4-methoxyphenyl)sulfonyl-N-(2-prop-2-enylsulfanylphenyl)piperidine-3-carboxamide Traditional Name: N-[2-(allylthio)phenyl]-1-(4-methoxyphenyl)sulfonyl-nipecotamide Formula: C22H26N2O4S2 MolecularWeight: 446.58284

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CCCC(C2)C(=O)NC3=CC=CC=C3SCC=C

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CCCC(C2)C(=O)NC3=CC=CC=C3SCC=C

InChI

InChI=1S/C22H26N2O4S2/c1-3-15-29-21-9-5-4-8-20(21)23-22(25)17-7-6-14-24(16-17)30(26,27)19-12-10-18(28-2)11-13-19/h3-5,8-13,17H,1,6-7,14-16H2,2H3,(H,23,25)