N-(2-fluorophenyl)-2-[(3-methylphenyl)methylsulfanyl]-5-(4-methylphenyl)sulfanyl-pyrimidine-4-carboxamide

Systemtic Name: N-(2-fluorophenyl)-2-[(3-methylphenyl)methylsulfanyl]-5-(4-methylphenyl)sulfanyl-pyrimidine-4-carboxamide Openeye Name: N-(2-fluorophenyl)-2-(m-tolylmethylsulfanyl)-5-(p-tolylsulfanyl)pyrimidine-4-carboxamide CAS Name: N-(2-fluorophenyl)-2-[(3-methylphenyl)methylthio]-5-[(4-methylphenyl)thio]-4-pyrimidinecarboxamide IUPAC Name: N-(2-fluorophenyl)-2-[(3-methylphenyl)methylsulfanyl]-5-(4-methylphenyl)sulfanylpyrimidine-4-carboxamide Traditional Name: N-(2-fluorophenyl)-2-[(3-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)SC2=CN=C(N=C2C(=O)NC3=CC=CC=C3F)SCC4=CC=CC(=C4)C

Isomeric SMILES

CC1=CC=C(C=C1)SC2=CN=C(N=C2C(=O)NC3=CC=CC=C3F)SCC4=CC=CC(=C4)C

InChI

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