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

Systemtic Name: 2-[(4-chlorophenyl)methylsulfanyl]-5-(4-chlorophenyl)sulfanyl-N-(4-methylphenyl)pyrimidine-4-carboxamide Openeye Name: 2-[(4-chlorophenyl)methylsulfanyl]-5-(4-chlorophenyl)sulfanyl-N-(p-tolyl)pyrimidine-4-carboxamide CAS Name: 2-[(4-chlorophenyl)methylthio]-5-[(4-chlorophenyl)thio]-N-(4-methylphenyl)-4-pyrimidinecarboxamide IUPAC Name: 2-[(4-chlorophenyl)methylsulfanyl]-5-(4-chlorophenyl)sulfanyl-N-(4-methylphenyl)pyrimidine-4-carboxamide Traditional Name: 2-[(4-chlorobenzyl)thio]-5-[(4-chlorophenyl)thio]-N-(p-tolyl)pyrimidine-4-carboxamide Formula: C25H19Cl2N3OS2 MolecularWeight: 512.47386

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C2=NC(=NC=C2SC3=CC=C(C=C3)Cl)SCC4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)C2=NC(=NC=C2SC3=CC=C(C=C3)Cl)SCC4=CC=C(C=C4)Cl

InChI

InChI=1S/C25H19Cl2N3OS2/c1-16-2-10-20(11-3-16)29-24(31)23-22(33-21-12-8-19(27)9-13-21)14-28-25(30-23)32-15-17-4-6-18(26)7-5-17/h2-14H,15H2,1H3,(H,29,31)