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

Systemtic Name: ethyl N-[[2-[1-(2-prop-2-enylsulfanylpyridin-3-yl)carbonylpiperidin-4-yl]-1,3-thiazol-4-yl]carbonylamino]carbamate Openeye Name: ethyl N-[[2-[1-(2-allylsulfanylpyridine-3-carbonyl)-4-piperidyl]thiazole-4-carbonyl]amino]carbamate CAS Name: N-[[oxo-[2-[1-[oxo-[2-(prop-2-enylthio)-3-pyridinyl]methyl]-4-piperidinyl]-4-thiazolyl]methyl]amino]carbamic acid ethyl ester IUPAC Name: ethyl N-[[2-[1-(2-prop-2-enylsulfanylpyridine-3-carbonyl)piperidin-4-yl]-1,3-thiazole-4-carbonyl]amino]carbamate Traditional Name: N-[[2-[1-[2-(allylthio)nicotinoyl]-4-piperidyl]thiazole-4-carbonyl]amino]carbamic acid ethyl ester Formula: C21H25N5O4S2 MolecularWeight: 475.5843

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25N5O4S2/c1-3-12-31-19-15(6-5-9-22-19)20(28)26-10-7-14(8-11-26)18-23-16(13-32-18)17(27)24-25-21(29)30-4-2/h3,5-6,9,13-14H,1,4,7-8,10-12H2,2H3,(H,24,27)(H,25,29)