N-(5-aminocarbonyl-2-methoxy-phenyl)-2-[1-(2-prop-2-enylsulfanylpyridin-3-yl)carbonylpiperidin-4-yl]-1,3-thiazole-4-carboxamide

Systemtic Name: N-(5-aminocarbonyl-2-methoxy-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-(5-carbamoyl-2-methoxy-phenyl)thiazole-4-carboxamide CAS Name: N-(5-carbamoyl-2-methoxyphenyl)-2-[1-[oxo-[2-(prop-2-enylthio)-3-pyridinyl]methyl]-4-piperidinyl]-4-thiazolecarboxamide IUPAC Name: N-(5-carbamoyl-2-methoxyphenyl)-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-(5-carbamoyl-2-methoxy-phenyl)thiazole-4-carboxamide Formula: C26H27N5O4S2 MolecularWeight: 537.65368

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)N)NC(=O)C2=CSC(=N2)C3CCN(CC3)C(=O)C4=C(N=CC=C4)SCC=C

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)N)NC(=O)C2=CSC(=N2)C3CCN(CC3)C(=O)C4=C(N=CC=C4)SCC=C

InChI

InChI=1S/C26H27N5O4S2/c1-3-13-36-25-18(5-4-10-28-25)26(34)31-11-8-16(9-12-31)24-30-20(15-37-24)23(33)29-19-14-17(22(27)32)6-7-21(19)35-2/h3-7,10,14-16H,1,8-9,11-13H2,2H3,(H2,27,32)(H,29,33)