methyl 3-[[1-[4-cyano-2-(furan-2-yl)-1,3-oxazol-5-yl]piperidin-4-yl]carbonylamino]-3-thiophen-2-yl-propanoate

Systemtic Name: methyl 3-[[1-[4-cyano-2-(furan-2-yl)-1,3-oxazol-5-yl]piperidin-4-yl]carbonylamino]-3-thiophen-2-yl-propanoate Openeye Name: methyl 3-[[1-[4-cyano-2-(2-furyl)oxazol-5-yl]piperidine-4-carbonyl]amino]-3-(2-thienyl)propanoate CAS Name: 3-[[[1-[4-cyano-2-(2-furanyl)-5-oxazolyl]-4-piperidinyl]-oxomethyl]amino]-3-thiophen-2-ylpropanoic acid methyl ester IUPAC Name: methyl 3-[[1-[4-cyano-2-(furan-2-yl)-1,3-oxazol-5-yl]piperidine-4-carbonyl]amino]-3-thiophen-2-ylpropanoate Traditional Name: 3-[[1-[4-cyano-2-(2-furyl)oxazol-5-yl]isonipecotoyl]amino]-3-(2-thienyl)propionic acid methyl ester Formula: C22H22N4O5S MolecularWeight: 454.49888

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(C1=CC=CS1)NC(=O)C2CCN(CC2)C3=C(N=C(O3)C4=CC=CO4)C#N

Isomeric SMILES

COC(=O)CC(C1=CC=CS1)NC(=O)C2CCN(CC2)C3=C(N=C(O3)C4=CC=CO4)C#N

InChI

InChI=1S/C22H22N4O5S/c1-29-19(27)12-15(18-5-3-11-32-18)24-20(28)14-6-8-26(9-7-14)22-16(13-23)25-21(31-22)17-4-2-10-30-17/h2-5,10-11,14-15H,6-9,12H2,1H3,(H,24,28)