5-(4-methylphenyl)sulfanyl-2-(phenylmethylsulfanyl)-N-pyridin-3-yl-pyrimidine-4-carboxamide

Systemtic Name: 5-(4-methylphenyl)sulfanyl-2-(phenylmethylsulfanyl)-N-pyridin-3-yl-pyrimidine-4-carboxamide Openeye Name: 2-benzylsulfanyl-5-(p-tolylsulfanyl)-N-(3-pyridyl)pyrimidine-4-carboxamide CAS Name: 5-[(4-methylphenyl)thio]-2-(phenylmethylthio)-N-(3-pyridinyl)-4-pyrimidinecarboxamide IUPAC Name: 2-benzylsulfanyl-5-(4-methylphenyl)sulfanyl-N-pyridin-3-ylpyrimidine-4-carboxamide Traditional Name: 2-(benzylthio)-5-(p-tolylthio)-N-(3-pyridyl)pyrimidine-4-carboxamide Formula: C24H20N4OS2 MolecularWeight: 444.5718

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=CN=C(N=C2C(=O)NC3=CN=CC=C3)SCC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)SC2=CN=C(N=C2C(=O)NC3=CN=CC=C3)SCC4=CC=CC=C4

InChI

InChI=1S/C24H20N4OS2/c1-17-9-11-20(12-10-17)31-21-15-26-24(30-16-18-6-3-2-4-7-18)28-22(21)23(29)27-19-8-5-13-25-14-19/h2-15H,16H2,1H3,(H,27,29)