ethyl 1-(2-hydroxyethyl)-6-methyl-2-phenyl-4-sulfanylidene-pyrimidine-5-carboxylate

Systemtic Name: ethyl 1-(2-hydroxyethyl)-6-methyl-2-phenyl-4-sulfanylidene-pyrimidine-5-carboxylate Openeye Name: ethyl 1-(2-hydroxyethyl)-6-methyl-2-phenyl-4-thioxo-pyrimidine-5-carboxylate CAS Name: 1-(2-hydroxyethyl)-6-methyl-2-phenyl-4-sulfanylidene-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-(2-hydroxyethyl)-6-methyl-2-phenyl-4-sulfanylidenepyrimidine-5-carboxylate Traditional Name: 1-(2-hydroxyethyl)-6-methyl-2-phenyl-4-thioxo-pyrimidine-5-carboxylic acid ethyl ester Formula: C16H18N2O3S MolecularWeight: 318.39072

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=NC1=S)C2=CC=CC=C2)CCO)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=NC1=S)C2=CC=CC=C2)CCO)C

InChI

InChI=1S/C16H18N2O3S/c1-3-21-16(20)13-11(2)18(9-10-19)14(17-15(13)22)12-7-5-4-6-8-12/h4-8,19H,3,9-10H2,1-2H3