ethyl 4-[[2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]pyridin-3-yl]carbonylamino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[[2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]pyridin-3-yl]carbonylamino]piperidine-1-carboxylate Openeye Name: ethyl 4-[[2-[(3,5-dimethylisoxazol-4-yl)methylsulfanyl]pyridine-3-carbonyl]amino]piperidine-1-carboxylate CAS Name: 4-[[[2-[(3,5-dimethyl-4-isoxazolyl)methylthio]-3-pyridinyl]-oxomethyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]pyridine-3-carbonyl]amino]piperidine-1-carboxylate Traditional Name: 4-[[2-[(3,5-dimethylisoxazol-4-yl)methylthio]nicotinoyl]amino]piperidine-1-carboxylic acid ethyl ester Formula: C20H26N4O4S MolecularWeight: 418.50984

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC(=O)C2=C(N=CC=C2)SCC3=C(ON=C3C)C

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC(=O)C2=C(N=CC=C2)SCC3=C(ON=C3C)C

InChI

InChI=1S/C20H26N4O4S/c1-4-27-20(26)24-10-7-15(8-11-24)22-18(25)16-6-5-9-21-19(16)29-12-17-13(2)23-28-14(17)3/h5-6,9,15H,4,7-8,10-12H2,1-3H3,(H,22,25)