N-(6-chloranylpyridin-3-yl)-2-[1-(2-prop-2-enylsulfanylpyridin-3-yl)carbonylpiperidin-4-yl]-1,3-thiazole-4-carboxamide

Systemtic Name: N-(6-chloranylpyridin-3-yl)-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-(6-chloro-3-pyridyl)thiazole-4-carboxamide CAS Name: N-(6-chloro-3-pyridinyl)-2-[1-[oxo-[2-(prop-2-enylthio)-3-pyridinyl]methyl]-4-piperidinyl]-4-thiazolecarboxamide IUPAC Name: N-(6-chloropyridin-3-yl)-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-(6-chloro-3-pyridyl)thiazole-4-carboxamide Formula: C23H22ClN5O2S2 MolecularWeight: 500.03608

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Descriptors Computed from Structure

Canonical SMILES:

C=CCSC1=C(C=CC=N1)C(=O)N2CCC(CC2)C3=NC(=CS3)C(=O)NC4=CN=C(C=C4)Cl

Isomeric SMILES

C=CCSC1=C(C=CC=N1)C(=O)N2CCC(CC2)C3=NC(=CS3)C(=O)NC4=CN=C(C=C4)Cl

InChI

InChI=1S/C23H22ClN5O2S2/c1-2-12-32-22-17(4-3-9-25-22)23(31)29-10-7-15(8-11-29)21-28-18(14-33-21)20(30)27-16-5-6-19(24)26-13-16/h2-6,9,13-15H,1,7-8,10-12H2,(H,27,30)