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

Systemtic Name: 2-[(4-methylphenyl)methylsulfanyl]-5-(4-methylphenyl)sulfanyl-N-pyridin-3-yl-pyrimidine-4-carboxamide Openeye Name: 2-(p-tolylmethylsulfanyl)-5-(p-tolylsulfanyl)-N-(3-pyridyl)pyrimidine-4-carboxamide CAS Name: 2-[(4-methylphenyl)methylthio]-5-[(4-methylphenyl)thio]-N-(3-pyridinyl)-4-pyrimidinecarboxamide IUPAC Name: 2-[(4-methylphenyl)methylsulfanyl]-5-(4-methylphenyl)sulfanyl-N-pyridin-3-ylpyrimidine-4-carboxamide Traditional Name: 2-[(4-methylbenzyl)thio]-5-(p-tolylthio)-N-(3-pyridyl)pyrimidine-4-carboxamide Formula: C25H22N4OS2 MolecularWeight: 458.59838

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H22N4OS2/c1-17-5-9-19(10-6-17)16-31-25-27-15-22(32-21-11-7-18(2)8-12-21)23(29-25)24(30)28-20-4-3-13-26-14-20/h3-15H,16H2,1-2H3,(H,28,30)