ethyl 6-(3-chlorophenyl)-4-methyl-3-propyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: ethyl 6-(3-chlorophenyl)-4-methyl-3-propyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 6-(3-chlorophenyl)-4-methyl-3-propyl-2-thioxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: 6-(3-chlorophenyl)-4-methyl-3-propyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-(3-chlorophenyl)-4-methyl-3-propyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 6-(3-chlorophenyl)-4-methyl-3-propyl-2-thioxo-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C17H21ClN2O2S MolecularWeight: 352.87884

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=C(C(NC1=S)C2=CC(=CC=C2)Cl)C(=O)OCC)C

Isomeric SMILES

CCCN1C(=C(C(NC1=S)C2=CC(=CC=C2)Cl)C(=O)OCC)C

InChI

InChI=1S/C17H21ClN2O2S/c1-4-9-20-11(3)14(16(21)22-5-2)15(19-17(20)23)12-7-6-8-13(18)10-12/h6-8,10,15H,4-5,9H2,1-3H3,(H,19,23)