(6R)-3-cyclopropyl-6-(2-fluorophenyl)-N-(3-methoxyphenyl)-4-methyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxamide

Systemtic Name: (6R)-3-cyclopropyl-6-(2-fluorophenyl)-N-(3-methoxyphenyl)-4-methyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxamide Openeye Name: (6R)-3-cyclopropyl-6-(2-fluorophenyl)-N-(3-methoxyphenyl)-4-methyl-2-thioxo-1,6-dihydropyrimidine-5-carboxamide CAS Name: (6R)-3-cyclopropyl-6-(2-fluorophenyl)-N-(3-methoxyphenyl)-4-methyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxamide IUPAC Name: (6R)-3-cyclopropyl-6-(2-fluorophenyl)-N-(3-methoxyphenyl)-4-methyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxamide Traditional Name: (6R)-3-cyclopropyl-6-(2-fluorophenyl)-N-(3-methoxyphenyl)-4-methyl-2-thioxo-1,6-dihydropyrimidine-5-carboxamide Formula: C22H22FN3O2S MolecularWeight: 411.492383

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=S)N1C2CC2)C3=CC=CC=C3F)C(=O)NC4=CC(=CC=C4)OC

Isomeric SMILES

CC1=C([C@@H](NC(=S)N1C2CC2)C3=CC=CC=C3F)C(=O)NC4=CC(=CC=C4)OC

InChI

InChI=1S/C22H22FN3O2S/c1-13-19(21(27)24-14-6-5-7-16(12-14)28-2)20(17-8-3-4-9-18(17)23)25-22(29)26(13)15-10-11-15/h3-9,12,15,20H,10-11H2,1-2H3,(H,24,27)(H,25,29)/t20-/m0/s1