ethyl 4-[4-(1-ethoxy-1-oxidanylidene-propan-2-yl)oxyphenyl]-6-phenyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-[4-(1-ethoxy-1-oxidanylidene-propan-2-yl)oxyphenyl]-6-phenyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 4-[4-(2-ethoxy-1-methyl-2-oxo-ethoxy)phenyl]-6-phenyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 4-[4-(1-ethoxy-1-oxopropan-2-yl)oxyphenyl]-6-phenyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-(1-ethoxy-1-oxopropan-2-yl)oxyphenyl]-6-phenyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 4-[4-(2-ethoxy-2-keto-1-methyl-ethoxy)phenyl]-6-phenyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C24H26N2O5S MolecularWeight: 454.53864

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=S)NC1C2=CC=C(C=C2)OC(C)C(=O)OCC)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(NC(=S)NC1C2=CC=C(C=C2)OC(C)C(=O)OCC)C3=CC=CC=C3

InChI

InChI=1S/C24H26N2O5S/c1-4-29-22(27)15(3)31-18-13-11-17(12-14-18)21-19(23(28)30-5-2)20(25-24(32)26-21)16-9-7-6-8-10-16/h6-15,21H,4-5H2,1-3H3,(H2,25,26,32)