3-(3-chloranyl-4-fluoranyl-phenyl)-N-(2-methoxyphenyl)-4-methyl-2-sulfanylidene-6-thiophen-3-yl-1,6-dihydropyrimidine-5-carboxamide

Systemtic Name: 3-(3-chloranyl-4-fluoranyl-phenyl)-N-(2-methoxyphenyl)-4-methyl-2-sulfanylidene-6-thiophen-3-yl-1,6-dihydropyrimidine-5-carboxamide Openeye Name: 3-(3-chloro-4-fluoro-phenyl)-N-(2-methoxyphenyl)-4-methyl-6-(3-thienyl)-2-thioxo-1,6-dihydropyrimidine-5-carboxamide CAS Name: 3-(3-chloro-4-fluorophenyl)-N-(2-methoxyphenyl)-4-methyl-2-sulfanylidene-6-(3-thiophenyl)-1,6-dihydropyrimidine-5-carboxamide IUPAC Name: 3-(3-chloro-4-fluorophenyl)-N-(2-methoxyphenyl)-4-methyl-2-sulfanylidene-6-thiophen-3-yl-1,6-dihydropyrimidine-5-carboxamide Traditional Name: 3-(3-chloro-4-fluoro-phenyl)-N-(2-methoxyphenyl)-4-methyl-6-(3-thienyl)-2-thioxo-1,6-dihydropyrimidine-5-carboxamide Formula: C23H19ClFN3O2S2 MolecularWeight: 487.997263

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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)NC4=CC=CC=C4OC

Isomeric SMILES

CC1=C(C(NC(=S)N1C2=CC(=C(C=C2)F)Cl)C3=CSC=C3)C(=O)NC4=CC=CC=C4OC

InChI

InChI=1S/C23H19ClFN3O2S2/c1-13-20(22(29)26-18-5-3-4-6-19(18)30-2)21(14-9-10-32-12-14)27-23(31)28(13)15-7-8-17(25)16(24)11-15/h3-12,21H,1-2H3,(H,26,29)(H,27,31)