1-(4-ethanoylphenyl)sulfonyl-N-(5-prop-2-enylsulfanyl-1,3,4-thiadiazol-2-yl)piperidine-4-carboxamide

Systemtic Name: 1-(4-ethanoylphenyl)sulfonyl-N-(5-prop-2-enylsulfanyl-1,3,4-thiadiazol-2-yl)piperidine-4-carboxamide Openeye Name: 1-(4-acetylphenyl)sulfonyl-N-(5-allylsulfanyl-1,3,4-thiadiazol-2-yl)piperidine-4-carboxamide CAS Name: 1-(4-acetylphenyl)sulfonyl-N-[5-(prop-2-enylthio)-1,3,4-thiadiazol-2-yl]-4-piperidinecarboxamide IUPAC Name: 1-(4-acetylphenyl)sulfonyl-N-(5-prop-2-enylsulfanyl-1,3,4-thiadiazol-2-yl)piperidine-4-carboxamide Traditional Name: 1-(4-acetylphenyl)sulfonyl-N-[5-(allylthio)-1,3,4-thiadiazol-2-yl]isonipecotamide Formula: C19H22N4O4S3 MolecularWeight: 466.59738

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=NN=C(S3)SCC=C

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=NN=C(S3)SCC=C

InChI

InChI=1S/C19H22N4O4S3/c1-3-12-28-19-22-21-18(29-19)20-17(25)15-8-10-23(11-9-15)30(26,27)16-6-4-14(5-7-16)13(2)24/h3-7,15H,1,8-12H2,2H3,(H,20,21,25)