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

Systemtic Name: ethyl 4-[(2-phenylsulfanylpyridin-3-yl)carbonylamino]piperidine-1-carboxylate Openeye Name: ethyl 4-[(2-phenylsulfanylpyridine-3-carbonyl)amino]piperidine-1-carboxylate CAS Name: 4-[[oxo-[2-(phenylthio)-3-pyridinyl]methyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(2-phenylsulfanylpyridine-3-carbonyl)amino]piperidine-1-carboxylate Traditional Name: 4-[[2-(phenylthio)nicotinoyl]amino]piperidine-1-carboxylic acid ethyl ester Formula: C20H23N3O3S MolecularWeight: 385.47992

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC(=O)C2=C(N=CC=C2)SC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC(=O)C2=C(N=CC=C2)SC3=CC=CC=C3

InChI

InChI=1S/C20H23N3O3S/c1-2-26-20(25)23-13-10-15(11-14-23)22-18(24)17-9-6-12-21-19(17)27-16-7-4-3-5-8-16/h3-9,12,15H,2,10-11,13-14H2,1H3,(H,22,24)