N-[(2-methylsulfanylphenyl)methyl]-2-[1-(2-prop-2-enylsulfanylpyridin-3-yl)carbonylpiperidin-4-yl]-1,3-thiazole-4-carboxamide

Systemtic Name: N-[(2-methylsulfanylphenyl)methyl]-2-[1-(2-prop-2-enylsulfanylpyridin-3-yl)carbonylpiperidin-4-yl]-1,3-thiazole-4-carboxamide Openeye Name: 2-[1-(2-allylsulfanylpyridine-3-carbonyl)-4-piperidyl]-N-[(2-methylsulfanylphenyl)methyl]thiazole-4-carboxamide CAS Name: N-[[2-(methylthio)phenyl]methyl]-2-[1-[oxo-[2-(prop-2-enylthio)-3-pyridinyl]methyl]-4-piperidinyl]-4-thiazolecarboxamide IUPAC Name: N-[(2-methylsulfanylphenyl)methyl]-2-[1-(2-prop-2-enylsulfanylpyridine-3-carbonyl)piperidin-4-yl]-1,3-thiazole-4-carboxamide Traditional Name: 2-[1-[2-(allylthio)nicotinoyl]-4-piperidyl]-N-[2-(methylthio)benzyl]thiazole-4-carboxamide Formula: C26H28N4O2S3 MolecularWeight: 524.72112

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1CNC(=O)C2=CSC(=N2)C3CCN(CC3)C(=O)C4=C(N=CC=C4)SCC=C

Isomeric SMILES

CSC1=CC=CC=C1CNC(=O)C2=CSC(=N2)C3CCN(CC3)C(=O)C4=C(N=CC=C4)SCC=C

InChI

InChI=1S/C26H28N4O2S3/c1-3-15-34-25-20(8-6-12-27-25)26(32)30-13-10-18(11-14-30)24-29-21(17-35-24)23(31)28-16-19-7-4-5-9-22(19)33-2/h3-9,12,17-18H,1,10-11,13-16H2,2H3,(H,28,31)