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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NO1)C(=O)NC2=C(C(=CS2)C3=CC=C(C=C3)C(C)(C)C)C(=O)OC

Isomeric SMILES

CC1=C(C=NO1)C(=O)NC2=C(C(=CS2)C3=CC=C(C=C3)C(C)(C)C)C(=O)OC

InChI

InChI=1S/C21H22N2O4S/c1-12-15(10-22-27-12)18(24)23-19-17(20(25)26-5)16(11-28-19)13-6-8-14(9-7-13)21(2,3)4/h6-11H,1-5H3,(H,23,24)