ethyl 3-[[2-[1-(2-prop-2-enylsulfanylpyridin-3-yl)carbonylpiperidin-4-yl]-1,3-thiazol-4-yl]carbonylamino]butanoate

Systemtic Name: ethyl 3-[[2-[1-(2-prop-2-enylsulfanylpyridin-3-yl)carbonylpiperidin-4-yl]-1,3-thiazol-4-yl]carbonylamino]butanoate Openeye Name: ethyl 3-[[2-[1-(2-allylsulfanylpyridine-3-carbonyl)-4-piperidyl]thiazole-4-carbonyl]amino]butanoate CAS Name: 3-[[oxo-[2-[1-[oxo-[2-(prop-2-enylthio)-3-pyridinyl]methyl]-4-piperidinyl]-4-thiazolyl]methyl]amino]butanoic acid ethyl ester IUPAC Name: ethyl 3-[[2-[1-(2-prop-2-enylsulfanylpyridine-3-carbonyl)piperidin-4-yl]-1,3-thiazole-4-carbonyl]amino]butanoate Traditional Name: 3-[[2-[1-[2-(allylthio)nicotinoyl]-4-piperidyl]thiazole-4-carbonyl]amino]butyric acid ethyl ester Formula: C24H30N4O4S2 MolecularWeight: 502.6494

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(C)NC(=O)C1=CSC(=N1)C2CCN(CC2)C(=O)C3=C(N=CC=C3)SCC=C

Isomeric SMILES

CCOC(=O)CC(C)NC(=O)C1=CSC(=N1)C2CCN(CC2)C(=O)C3=C(N=CC=C3)SCC=C

InChI

InChI=1S/C24H30N4O4S2/c1-4-13-33-23-18(7-6-10-25-23)24(31)28-11-8-17(9-12-28)22-27-19(15-34-22)21(30)26-16(3)14-20(29)32-5-2/h4,6-7,10,15-17H,1,5,8-9,11-14H2,2-3H3,(H,26,30)