ethyl 2-[(4R)-4-(4-chlorophenyl)-6-phenyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidin-5-yl]-2-oxidanylidene-ethanoate

Systemtic Name: ethyl 2-[(4R)-4-(4-chlorophenyl)-6-phenyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidin-5-yl]-2-oxidanylidene-ethanoate Openeye Name: ethyl 2-[(4R)-4-(4-chlorophenyl)-6-phenyl-2-thioxo-3,4-dihydro-1H-pyrimidin-5-yl]-2-oxo-acetate CAS Name: 2-[(4R)-4-(4-chlorophenyl)-6-phenyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidin-5-yl]-2-oxoacetic acid ethyl ester IUPAC Name: ethyl 2-[(4R)-4-(4-chlorophenyl)-6-phenyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidin-5-yl]-2-oxoacetate Traditional Name: 2-[(4R)-4-(4-chlorophenyl)-6-phenyl-2-thioxo-3,4-dihydro-1H-pyrimidin-5-yl]-2-keto-acetic acid ethyl ester Formula: C20H17ClN2O3S MolecularWeight: 400.87858

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCOC(=O)C(=O)C1=C(NC(=S)N[C@@H]1C2=CC=C(C=C2)Cl)C3=CC=CC=C3

InChI

InChI=1S/C20H17ClN2O3S/c1-2-26-19(25)18(24)15-16(12-6-4-3-5-7-12)22-20(27)23-17(15)13-8-10-14(21)11-9-13/h3-11,17H,2H2,1H3,(H2,22,23,27)/t17-/m1/s1