2-[(2-methylphenyl)methylsulfanyl]-5-(4-methylphenyl)sulfanyl-N-(1,3-thiazol-2-yl)pyrimidine-4-carboxamide

Systemtic Name: 2-[(2-methylphenyl)methylsulfanyl]-5-(4-methylphenyl)sulfanyl-N-(1,3-thiazol-2-yl)pyrimidine-4-carboxamide Openeye Name: 2-(o-tolylmethylsulfanyl)-5-(p-tolylsulfanyl)-N-thiazol-2-yl-pyrimidine-4-carboxamide CAS Name: 2-[(2-methylphenyl)methylthio]-5-[(4-methylphenyl)thio]-N-(2-thiazolyl)-4-pyrimidinecarboxamide IUPAC Name: 2-[(2-methylphenyl)methylsulfanyl]-5-(4-methylphenyl)sulfanyl-N-(1,3-thiazol-2-yl)pyrimidine-4-carboxamide Traditional Name: 2-[(2-methylbenzyl)thio]-5-(p-tolylthio)-N-thiazol-2-yl-pyrimidine-4-carboxamide Formula: C23H20N4OS3 MolecularWeight: 464.6261

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=CN=C(N=C2C(=O)NC3=NC=CS3)SCC4=CC=CC=C4C

Isomeric SMILES

CC1=CC=C(C=C1)SC2=CN=C(N=C2C(=O)NC3=NC=CS3)SCC4=CC=CC=C4C

InChI

InChI=1S/C23H20N4OS3/c1-15-7-9-18(10-8-15)31-19-13-25-23(30-14-17-6-4-3-5-16(17)2)26-20(19)21(28)27-22-24-11-12-29-22/h3-13H,14H2,1-2H3,(H,24,27,28)