N-(2,5-dimethoxyphenyl)-6-methyl-2-sulfanylidene-4-[3-(trifluoromethyl)phenyl]-3,4-dihydro-1H-pyrimidine-5-carboxamide

Systemtic Name: N-(2,5-dimethoxyphenyl)-6-methyl-2-sulfanylidene-4-[3-(trifluoromethyl)phenyl]-3,4-dihydro-1H-pyrimidine-5-carboxamide Openeye Name: N-(2,5-dimethoxyphenyl)-6-methyl-2-thioxo-4-[3-(trifluoromethyl)phenyl]-3,4-dihydro-1H-pyrimidine-5-carboxamide CAS Name: N-(2,5-dimethoxyphenyl)-6-methyl-2-sulfanylidene-4-[3-(trifluoromethyl)phenyl]-3,4-dihydro-1H-pyrimidine-5-carboxamide IUPAC Name: N-(2,5-dimethoxyphenyl)-6-methyl-2-sulfanylidene-4-[3-(trifluoromethyl)phenyl]-3,4-dihydro-1H-pyrimidine-5-carboxamide Traditional Name: N-(2,5-dimethoxyphenyl)-6-methyl-2-thioxo-4-[3-(trifluoromethyl)phenyl]-3,4-dihydro-1H-pyrimidine-5-carboxamide Formula: C21H20F3N3O3S MolecularWeight: 451.46201

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=S)N1)C2=CC(=CC=C2)C(F)(F)F)C(=O)NC3=C(C=CC(=C3)OC)OC

Isomeric SMILES

CC1=C(C(NC(=S)N1)C2=CC(=CC=C2)C(F)(F)F)C(=O)NC3=C(C=CC(=C3)OC)OC

InChI

InChI=1S/C21H20F3N3O3S/c1-11-17(19(28)26-15-10-14(29-2)7-8-16(15)30-3)18(27-20(31)25-11)12-5-4-6-13(9-12)21(22,23)24/h4-10,18H,1-3H3,(H,26,28)(H2,25,27,31)