ethyl 4-(4-chlorophenyl)-2-oxidanylidene-6-(2-thiophen-2-ylethanoyloxymethyl)-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-(4-chlorophenyl)-2-oxidanylidene-6-(2-thiophen-2-ylethanoyloxymethyl)-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 4-(4-chlorophenyl)-2-oxo-6-[[2-(2-thienyl)acetyl]oxymethyl]-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 4-(4-chlorophenyl)-2-oxo-6-[(1-oxo-2-thiophen-2-ylethoxy)methyl]-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-chlorophenyl)-2-oxo-6-[(2-thiophen-2-ylacetyl)oxymethyl]-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 4-(4-chlorophenyl)-2-keto-6-[[2-(2-thienyl)acetyl]oxymethyl]-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C20H19ClN2O5S MolecularWeight: 434.89326

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1C2=CC=C(C=C2)Cl)COC(=O)CC3=CC=CS3

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)NC1C2=CC=C(C=C2)Cl)COC(=O)CC3=CC=CS3

InChI

InChI=1S/C20H19ClN2O5S/c1-2-27-19(25)17-15(11-28-16(24)10-14-4-3-9-29-14)22-20(26)23-18(17)12-5-7-13(21)8-6-12/h3-9,18H,2,10-11H2,1H3,(H2,22,23,26)