ethyl 5-ethyl-2-[3-(2-oxidanylidene-1,3-benzoxazol-3-yl)propanoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 5-ethyl-2-[3-(2-oxidanylidene-1,3-benzoxazol-3-yl)propanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 5-ethyl-2-[3-(2-oxo-1,3-benzoxazol-3-yl)propanoylamino]thiophene-3-carboxylate CAS Name: 5-ethyl-2-[[1-oxo-3-(2-oxo-1,3-benzoxazol-3-yl)propyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-ethyl-2-[3-(2-oxo-1,3-benzoxazol-3-yl)propanoylamino]thiophene-3-carboxylate Traditional Name: 5-ethyl-2-[3-(2-keto-1,3-benzoxazol-3-yl)propanoylamino]thiophene-3-carboxylic acid ethyl ester Formula: C19H20N2O5S MolecularWeight: 388.4375

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(S1)NC(=O)CCN2C3=CC=CC=C3OC2=O)C(=O)OCC

Isomeric SMILES

CCC1=CC(=C(S1)NC(=O)CCN2C3=CC=CC=C3OC2=O)C(=O)OCC

InChI

InChI=1S/C19H20N2O5S/c1-3-12-11-13(18(23)25-4-2)17(27-12)20-16(22)9-10-21-14-7-5-6-8-15(14)26-19(21)24/h5-8,11H,3-4,9-10H2,1-2H3,(H,20,22)