N-(4-fluorophenyl)-2-[(4-methylphenyl)methylsulfanyl]-5-(4-methylphenyl)sulfanyl-pyrimidine-4-carboxamide

Systemtic Name: N-(4-fluorophenyl)-2-[(4-methylphenyl)methylsulfanyl]-5-(4-methylphenyl)sulfanyl-pyrimidine-4-carboxamide Openeye Name: N-(4-fluorophenyl)-2-(p-tolylmethylsulfanyl)-5-(p-tolylsulfanyl)pyrimidine-4-carboxamide CAS Name: N-(4-fluorophenyl)-2-[(4-methylphenyl)methylthio]-5-[(4-methylphenyl)thio]-4-pyrimidinecarboxamide IUPAC Name: N-(4-fluorophenyl)-2-[(4-methylphenyl)methylsulfanyl]-5-(4-methylphenyl)sulfanylpyrimidine-4-carboxamide Traditional Name: N-(4-fluorophenyl)-2-[(4-methylbenzyl)thio]-5-(p-tolylthio)pyrimidine-4-carboxamide Formula: C26H22FN3OS2 MolecularWeight: 475.600783

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSC2=NC=C(C(=N2)C(=O)NC3=CC=C(C=C3)F)SC4=CC=C(C=C4)C

Isomeric SMILES

CC1=CC=C(C=C1)CSC2=NC=C(C(=N2)C(=O)NC3=CC=C(C=C3)F)SC4=CC=C(C=C4)C

InChI

InChI=1S/C26H22FN3OS2/c1-17-3-7-19(8-4-17)16-32-26-28-15-23(33-22-13-5-18(2)6-14-22)24(30-26)25(31)29-21-11-9-20(27)10-12-21/h3-15H,16H2,1-2H3,(H,29,31)