N-(3-oxidanylidene-1H-2-benzofuran-5-yl)-2-[1-(2-prop-2-enylsulfanylpyridin-3-yl)carbonylpiperidin-4-yl]-1,3-thiazole-4-carboxamide

Systemtic Name: N-(3-oxidanylidene-1H-2-benzofuran-5-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-(3-oxo-1H-isobenzofuran-5-yl)thiazole-4-carboxamide CAS Name: N-(3-oxo-1H-isobenzofuran-5-yl)-2-[1-[oxo-[2-(prop-2-enylthio)-3-pyridinyl]methyl]-4-piperidinyl]-4-thiazolecarboxamide IUPAC Name: N-(3-oxo-1H-2-benzofuran-5-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-(3-ketophthalan-5-yl)thiazole-4-carboxamide Formula: C26H24N4O4S2 MolecularWeight: 520.62316

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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=CC5=C(COC5=O)C=C4

Isomeric SMILES

C=CCSC1=C(C=CC=N1)C(=O)N2CCC(CC2)C3=NC(=CS3)C(=O)NC4=CC5=C(COC5=O)C=C4

InChI

InChI=1S/C26H24N4O4S2/c1-2-12-35-24-19(4-3-9-27-24)25(32)30-10-7-16(8-11-30)23-29-21(15-36-23)22(31)28-18-6-5-17-14-34-26(33)20(17)13-18/h2-6,9,13,15-16H,1,7-8,10-12,14H2,(H,28,31)