2-(3-fluorophenyl)-4-(2-hydroxyethylamino)-6-methylsulfanyl-N-(4-methylsulfanylphenyl)pyrimidine-5-carboxamide

Systemtic Name: 2-(3-fluorophenyl)-4-(2-hydroxyethylamino)-6-methylsulfanyl-N-(4-methylsulfanylphenyl)pyrimidine-5-carboxamide Openeye Name: 2-(3-fluorophenyl)-4-(2-hydroxyethylamino)-6-methylsulfanyl-N-(4-methylsulfanylphenyl)pyrimidine-5-carboxamide CAS Name: 2-(3-fluorophenyl)-4-(2-hydroxyethylamino)-6-(methylthio)-N-[4-(methylthio)phenyl]-5-pyrimidinecarboxamide IUPAC Name: 2-(3-fluorophenyl)-4-(2-hydroxyethylamino)-6-methylsulfanyl-N-(4-methylsulfanylphenyl)pyrimidine-5-carboxamide Traditional Name: 2-(3-fluorophenyl)-4-(2-hydroxyethylamino)-6-(methylthio)-N-[4-(methylthio)phenyl]pyrimidine-5-carboxamide Formula: C21H21FN4O2S2 MolecularWeight: 444.545443

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)NC(=O)C2=C(N=C(N=C2SC)C3=CC(=CC=C3)F)NCCO

Isomeric SMILES

CSC1=CC=C(C=C1)NC(=O)C2=C(N=C(N=C2SC)C3=CC(=CC=C3)F)NCCO

InChI

InChI=1S/C21H21FN4O2S2/c1-29-16-8-6-15(7-9-16)24-20(28)17-19(23-10-11-27)25-18(26-21(17)30-2)13-4-3-5-14(22)12-13/h3-9,12,27H,10-11H2,1-2H3,(H,24,28)(H,23,25,26)