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

Systemtic Name: 5-(4-chlorophenyl)sulfanyl-N-(2-methoxyphenyl)-2-[(4-methylphenyl)methylsulfanyl]pyrimidine-4-carboxamide Openeye Name: 5-(4-chlorophenyl)sulfanyl-N-(2-methoxyphenyl)-2-(p-tolylmethylsulfanyl)pyrimidine-4-carboxamide CAS Name: 5-[(4-chlorophenyl)thio]-N-(2-methoxyphenyl)-2-[(4-methylphenyl)methylthio]-4-pyrimidinecarboxamide IUPAC Name: 5-(4-chlorophenyl)sulfanyl-N-(2-methoxyphenyl)-2-[(4-methylphenyl)methylsulfanyl]pyrimidine-4-carboxamide Traditional Name: 5-[(4-chlorophenyl)thio]-N-(2-methoxyphenyl)-2-[(4-methylbenzyl)thio]pyrimidine-4-carboxamide Formula: C26H22ClN3O2S2 MolecularWeight: 508.05478

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSC2=NC=C(C(=N2)C(=O)NC3=CC=CC=C3OC)SC4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=CC=C(C=C1)CSC2=NC=C(C(=N2)C(=O)NC3=CC=CC=C3OC)SC4=CC=C(C=C4)Cl

InChI

InChI=1S/C26H22ClN3O2S2/c1-17-7-9-18(10-8-17)16-33-26-28-15-23(34-20-13-11-19(27)12-14-20)24(30-26)25(31)29-21-5-3-4-6-22(21)32-2/h3-15H,16H2,1-2H3,(H,29,31)