N-(2,3-dimethyl-4-oxidanyl-phenyl)-2-[1-(2-prop-2-enylsulfanylpyridin-3-yl)carbonylpiperidin-4-yl]-1,3-thiazole-4-carboxamide

Systemtic Name: N-(2,3-dimethyl-4-oxidanyl-phenyl)-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-(4-hydroxy-2,3-dimethyl-phenyl)thiazole-4-carboxamide CAS Name: N-(4-hydroxy-2,3-dimethylphenyl)-2-[1-[oxo-[2-(prop-2-enylthio)-3-pyridinyl]methyl]-4-piperidinyl]-4-thiazolecarboxamide IUPAC Name: N-(4-hydroxy-2,3-dimethylphenyl)-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-(4-hydroxy-2,3-dimethyl-phenyl)thiazole-4-carboxamide Formula: C26H28N4O3S2 MolecularWeight: 508.65552

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1C)O)NC(=O)C2=CSC(=N2)C3CCN(CC3)C(=O)C4=C(N=CC=C4)SCC=C

Isomeric SMILES

CC1=C(C=CC(=C1C)O)NC(=O)C2=CSC(=N2)C3CCN(CC3)C(=O)C4=C(N=CC=C4)SCC=C

InChI

InChI=1S/C26H28N4O3S2/c1-4-14-34-25-19(6-5-11-27-25)26(33)30-12-9-18(10-13-30)24-29-21(15-35-24)23(32)28-20-7-8-22(31)17(3)16(20)2/h4-8,11,15,18,31H,1,9-10,12-14H2,2-3H3,(H,28,32)