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

Systemtic Name: methyl 5-(4-chlorophenyl)-3-[(5-methyl-3-phenyl-1,2-oxazol-4-yl)carbonylamino]thiophene-2-carboxylate Openeye Name: methyl 5-(4-chlorophenyl)-3-[(5-methyl-3-phenyl-isoxazole-4-carbonyl)amino]thiophene-2-carboxylate CAS Name: 5-(4-chlorophenyl)-3-[[(5-methyl-3-phenyl-4-isoxazolyl)-oxomethyl]amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-(4-chlorophenyl)-3-[(5-methyl-3-phenyl-1,2-oxazole-4-carbonyl)amino]thiophene-2-carboxylate Traditional Name: 5-(4-chlorophenyl)-3-[(5-methyl-3-phenyl-isoxazole-4-carbonyl)amino]thiophene-2-carboxylic acid methyl ester Formula: C23H17ClN2O4S MolecularWeight: 452.91008

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C2=CC=CC=C2)C(=O)NC3=C(SC(=C3)C4=CC=C(C=C4)Cl)C(=O)OC

Isomeric SMILES

CC1=C(C(=NO1)C2=CC=CC=C2)C(=O)NC3=C(SC(=C3)C4=CC=C(C=C4)Cl)C(=O)OC

InChI

InChI=1S/C23H17ClN2O4S/c1-13-19(20(26-30-13)15-6-4-3-5-7-15)22(27)25-17-12-18(31-21(17)23(28)29-2)14-8-10-16(24)11-9-14/h3-12H,1-2H3,(H,25,27)