ethyl 4-ethyl-5-methyl-2-[(5-methyl-3-phenyl-1,2-oxazol-4-yl)carbonylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4-ethyl-5-methyl-2-[(5-methyl-3-phenyl-1,2-oxazol-4-yl)carbonylamino]thiophene-3-carboxylate Openeye Name: ethyl 4-ethyl-5-methyl-2-[(5-methyl-3-phenyl-isoxazole-4-carbonyl)amino]thiophene-3-carboxylate CAS Name: 4-ethyl-5-methyl-2-[[(5-methyl-3-phenyl-4-isoxazolyl)-oxomethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-ethyl-5-methyl-2-[(5-methyl-3-phenyl-1,2-oxazole-4-carbonyl)amino]thiophene-3-carboxylate Traditional Name: 4-ethyl-5-methyl-2-[(5-methyl-3-phenyl-isoxazole-4-carbonyl)amino]thiophene-3-carboxylic acid ethyl ester Formula: C21H22N2O4S MolecularWeight: 398.47538

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC(=C1C(=O)OCC)NC(=O)C2=C(ON=C2C3=CC=CC=C3)C)C

Isomeric SMILES

CCC1=C(SC(=C1C(=O)OCC)NC(=O)C2=C(ON=C2C3=CC=CC=C3)C)C

InChI

InChI=1S/C21H22N2O4S/c1-5-15-13(4)28-20(17(15)21(25)26-6-2)22-19(24)16-12(3)27-23-18(16)14-10-8-7-9-11-14/h7-11H,5-6H2,1-4H3,(H,22,24)