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

Systemtic Name: 5-(4-chlorophenyl)sulfanyl-N-(4-methylphenyl)-2-[(4-methylphenyl)methylsulfanyl]pyrimidine-4-carboxamide Openeye Name: 5-(4-chlorophenyl)sulfanyl-N-(p-tolyl)-2-(p-tolylmethylsulfanyl)pyrimidine-4-carboxamide CAS Name: 5-[(4-chlorophenyl)thio]-N-(4-methylphenyl)-2-[(4-methylphenyl)methylthio]-4-pyrimidinecarboxamide IUPAC Name: 5-(4-chlorophenyl)sulfanyl-N-(4-methylphenyl)-2-[(4-methylphenyl)methylsulfanyl]pyrimidine-4-carboxamide Traditional Name: 5-[(4-chlorophenyl)thio]-2-[(4-methylbenzyl)thio]-N-(p-tolyl)pyrimidine-4-carboxamide Formula: C26H22ClN3OS2 MolecularWeight: 492.05538

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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)C)SC4=CC=C(C=C4)Cl

Isomeric SMILES

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

InChI

InChI=1S/C26H22ClN3OS2/c1-17-3-7-19(8-4-17)16-32-26-28-15-23(33-22-13-9-20(27)10-14-22)24(30-26)25(31)29-21-11-5-18(2)6-12-21/h3-15H,16H2,1-2H3,(H,29,31)