2-methoxyethyl 3-(3-chloranyl-4-fluoranyl-phenyl)-4-methyl-2-sulfanylidene-6-thiophen-3-yl-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: 2-methoxyethyl 3-(3-chloranyl-4-fluoranyl-phenyl)-4-methyl-2-sulfanylidene-6-thiophen-3-yl-1,6-dihydropyrimidine-5-carboxylate Openeye Name: 2-methoxyethyl 3-(3-chloro-4-fluoro-phenyl)-4-methyl-6-(3-thienyl)-2-thioxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: 3-(3-chloro-4-fluorophenyl)-4-methyl-2-sulfanylidene-6-(3-thiophenyl)-1,6-dihydropyrimidine-5-carboxylic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl 3-(3-chloro-4-fluorophenyl)-4-methyl-2-sulfanylidene-6-thiophen-3-yl-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 3-(3-chloro-4-fluoro-phenyl)-4-methyl-6-(3-thienyl)-2-thioxo-1,6-dihydropyrimidine-5-carboxylic acid 2-methoxyethyl ester Formula: C19H18ClFN2O3S2 MolecularWeight: 440.939223

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=S)N1C2=CC(=C(C=C2)F)Cl)C3=CSC=C3)C(=O)OCCOC

Isomeric SMILES

CC1=C(C(NC(=S)N1C2=CC(=C(C=C2)F)Cl)C3=CSC=C3)C(=O)OCCOC

InChI

InChI=1S/C19H18ClFN2O3S2/c1-11-16(18(24)26-7-6-25-2)17(12-5-8-28-10-12)22-19(27)23(11)13-3-4-15(21)14(20)9-13/h3-5,8-10,17H,6-7H2,1-2H3,(H,22,27)