ethyl 1-[2-[1-[(5-methyl-1,2-oxazol-3-yl)amino]-1-oxidanylidene-propan-2-yl]sulfanylethanoyl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[2-[1-[(5-methyl-1,2-oxazol-3-yl)amino]-1-oxidanylidene-propan-2-yl]sulfanylethanoyl]piperidine-4-carboxylate Openeye Name: ethyl 1-[2-[1-methyl-2-[(5-methylisoxazol-3-yl)amino]-2-oxo-ethyl]sulfanylacetyl]piperidine-4-carboxylate CAS Name: 1-[2-[[1-[(5-methyl-3-isoxazolyl)amino]-1-oxopropan-2-yl]thio]-1-oxoethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-[1-[(5-methyl-1,2-oxazol-3-yl)amino]-1-oxopropan-2-yl]sulfanylacetyl]piperidine-4-carboxylate Traditional Name: 1-[2-[[2-keto-1-methyl-2-[(5-methylisoxazol-3-yl)amino]ethyl]thio]acetyl]isonipecotic acid ethyl ester Formula: C17H25N3O5S MolecularWeight: 383.4625

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)CSC(C)C(=O)NC2=NOC(=C2)C

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)CSC(C)C(=O)NC2=NOC(=C2)C

InChI

InChI=1S/C17H25N3O5S/c1-4-24-17(23)13-5-7-20(8-6-13)15(21)10-26-12(3)16(22)18-14-9-11(2)25-19-14/h9,12-13H,4-8,10H2,1-3H3,(H,18,19,22)