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

Systemtic Name: N-[(4-methoxyphenyl)methyl]-2-[(4-methylphenyl)methylsulfanyl]-5-(4-methylphenyl)sulfanyl-pyrimidine-4-carboxamide Openeye Name: N-[(4-methoxyphenyl)methyl]-2-(p-tolylmethylsulfanyl)-5-(p-tolylsulfanyl)pyrimidine-4-carboxamide CAS Name: N-[(4-methoxyphenyl)methyl]-2-[(4-methylphenyl)methylthio]-5-[(4-methylphenyl)thio]-4-pyrimidinecarboxamide IUPAC Name: N-[(4-methoxyphenyl)methyl]-2-[(4-methylphenyl)methylsulfanyl]-5-(4-methylphenyl)sulfanylpyrimidine-4-carboxamide Traditional Name: 2-[(4-methylbenzyl)thio]-N-p-anisyl-5-(p-tolylthio)pyrimidine-4-carboxamide Formula: C28H27N3O2S2 MolecularWeight: 501.66288

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSC2=NC=C(C(=N2)C(=O)NCC3=CC=C(C=C3)OC)SC4=CC=C(C=C4)C

Isomeric SMILES

CC1=CC=C(C=C1)CSC2=NC=C(C(=N2)C(=O)NCC3=CC=C(C=C3)OC)SC4=CC=C(C=C4)C

InChI

InChI=1S/C28H27N3O2S2/c1-19-4-8-22(9-5-19)18-34-28-30-17-25(35-24-14-6-20(2)7-15-24)26(31-28)27(32)29-16-21-10-12-23(33-3)13-11-21/h4-15,17H,16,18H2,1-3H3,(H,29,32)