N-(2-cyanoethyl)-N-(furan-2-ylmethyl)-2-[1-(2-prop-2-enylsulfanylpyridin-3-yl)carbonylpiperidin-4-yl]-1,3-thiazole-4-carboxamide

Systemtic Name: N-(2-cyanoethyl)-N-(furan-2-ylmethyl)-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-cyanoethyl)-N-(2-furylmethyl)thiazole-4-carboxamide CAS Name: N-(2-cyanoethyl)-N-(2-furanylmethyl)-2-[1-[oxo-[2-(prop-2-enylthio)-3-pyridinyl]methyl]-4-piperidinyl]-4-thiazolecarboxamide IUPAC Name: N-(2-cyanoethyl)-N-(furan-2-ylmethyl)-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-cyanoethyl)-N-(2-furfuryl)thiazole-4-carboxamide Formula: C26H27N5O3S2 MolecularWeight: 521.65428

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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)N(CCC#N)CC4=CC=CO4

Isomeric SMILES

C=CCSC1=C(C=CC=N1)C(=O)N2CCC(CC2)C3=NC(=CS3)C(=O)N(CCC#N)CC4=CC=CO4

InChI

InChI=1S/C26H27N5O3S2/c1-2-16-35-24-21(7-3-11-28-24)25(32)30-13-8-19(9-14-30)23-29-22(18-36-23)26(33)31(12-5-10-27)17-20-6-4-15-34-20/h2-4,6-7,11,15,18-19H,1,5,8-9,12-14,16-17H2