methyl 3-[(5-pyridin-3-yl-1,2-oxazol-3-yl)carbonylamino]-3-thiophen-2-yl-propanoate

Systemtic Name: methyl 3-[(5-pyridin-3-yl-1,2-oxazol-3-yl)carbonylamino]-3-thiophen-2-yl-propanoate Openeye Name: methyl 3-[[5-(3-pyridyl)isoxazole-3-carbonyl]amino]-3-(2-thienyl)propanoate CAS Name: 3-[[oxo-[5-(3-pyridinyl)-3-isoxazolyl]methyl]amino]-3-thiophen-2-ylpropanoic acid methyl ester IUPAC Name: methyl 3-[(5-pyridin-3-yl-1,2-oxazole-3-carbonyl)amino]-3-thiophen-2-ylpropanoate Traditional Name: 3-[[5-(3-pyridyl)isoxazole-3-carbonyl]amino]-3-(2-thienyl)propionic acid methyl ester Formula: C17H15N3O4S MolecularWeight: 357.3837

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(C1=CC=CS1)NC(=O)C2=NOC(=C2)C3=CN=CC=C3

Isomeric SMILES

COC(=O)CC(C1=CC=CS1)NC(=O)C2=NOC(=C2)C3=CN=CC=C3

InChI

InChI=1S/C17H15N3O4S/c1-23-16(21)9-12(15-5-3-7-25-15)19-17(22)13-8-14(24-20-13)11-4-2-6-18-10-11/h2-8,10,12H,9H2,1H3,(H,19,22)