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

Systemtic Name: 6-methyl-N-(4-nitrophenyl)-2-sulfanylidene-4-[4-(trifluoromethyloxy)phenyl]-3,4-dihydro-1H-pyrimidine-5-carboxamide Openeye Name: 6-methyl-N-(4-nitrophenyl)-2-thioxo-4-[4-(trifluoromethoxy)phenyl]-3,4-dihydro-1H-pyrimidine-5-carboxamide CAS Name: 6-methyl-N-(4-nitrophenyl)-2-sulfanylidene-4-[4-(trifluoromethoxy)phenyl]-3,4-dihydro-1H-pyrimidine-5-carboxamide IUPAC Name: 6-methyl-N-(4-nitrophenyl)-2-sulfanylidene-4-[4-(trifluoromethoxy)phenyl]-3,4-dihydro-1H-pyrimidine-5-carboxamide Traditional Name: 6-methyl-N-(4-nitrophenyl)-2-thioxo-4-[4-(trifluoromethoxy)phenyl]-3,4-dihydro-1H-pyrimidine-5-carboxamide Formula: C19H15F3N4O4S MolecularWeight: 452.40701

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=S)N1)C2=CC=C(C=C2)OC(F)(F)F)C(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(NC(=S)N1)C2=CC=C(C=C2)OC(F)(F)F)C(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H15F3N4O4S/c1-10-15(17(27)24-12-4-6-13(7-5-12)26(28)29)16(25-18(31)23-10)11-2-8-14(9-3-11)30-19(20,21)22/h2-9,16H,1H3,(H,24,27)(H2,23,25,31)