ethyl 4-(4-chlorophenyl)-2-[2-(2,4-dimethyl-6-oxidanylidene-pyrimidin-1-yl)ethanoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4-(4-chlorophenyl)-2-[2-(2,4-dimethyl-6-oxidanylidene-pyrimidin-1-yl)ethanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 4-(4-chlorophenyl)-2-[[2-(2,4-dimethyl-6-oxo-pyrimidin-1-yl)acetyl]amino]thiophene-3-carboxylate CAS Name: 4-(4-chlorophenyl)-2-[[2-(2,4-dimethyl-6-oxo-1-pyrimidinyl)-1-oxoethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-chlorophenyl)-2-[[2-(2,4-dimethyl-6-oxopyrimidin-1-yl)acetyl]amino]thiophene-3-carboxylate Traditional Name: 4-(4-chlorophenyl)-2-[[2-(6-keto-2,4-dimethyl-pyrimidin-1-yl)acetyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C21H20ClN3O4S MolecularWeight: 445.9192

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)Cl)NC(=O)CN3C(=NC(=CC3=O)C)C

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)Cl)NC(=O)CN3C(=NC(=CC3=O)C)C

InChI

InChI=1S/C21H20ClN3O4S/c1-4-29-21(28)19-16(14-5-7-15(22)8-6-14)11-30-20(19)24-17(26)10-25-13(3)23-12(2)9-18(25)27/h5-9,11H,4,10H2,1-3H3,(H,24,26)