ethyl 4-[(2-prop-2-enylsulfanylpyridin-3-yl)carbonylamino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[(2-prop-2-enylsulfanylpyridin-3-yl)carbonylamino]piperidine-1-carboxylate Openeye Name: ethyl 4-[(2-allylsulfanylpyridine-3-carbonyl)amino]piperidine-1-carboxylate CAS Name: 4-[[oxo-[2-(prop-2-enylthio)-3-pyridinyl]methyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(2-prop-2-enylsulfanylpyridine-3-carbonyl)amino]piperidine-1-carboxylate Traditional Name: 4-[[2-(allylthio)nicotinoyl]amino]piperidine-1-carboxylic acid ethyl ester Formula: C17H23N3O3S MolecularWeight: 349.44782

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC(=O)C2=C(N=CC=C2)SCC=C

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC(=O)C2=C(N=CC=C2)SCC=C

InChI

InChI=1S/C17H23N3O3S/c1-3-12-24-16-14(6-5-9-18-16)15(21)19-13-7-10-20(11-8-13)17(22)23-4-2/h3,5-6,9,13H,1,4,7-8,10-12H2,2H3,(H,19,21)