N6-(2-methylpropyl)-2-methylsulfanyl-N4-[2,4,6-tris(chloranyl)phenyl]pyrimidine-4,6-diamine

Systemtic Name: N6-(2-methylpropyl)-2-methylsulfanyl-N4-[2,4,6-tris(chloranyl)phenyl]pyrimidine-4,6-diamine Openeye Name: N6-isobutyl-2-methylsulfanyl-N4-(2,4,6-trichlorophenyl)pyrimidine-4,6-diamine CAS Name: N6-(2-methylpropyl)-2-(methylthio)-N4-(2,4,6-trichlorophenyl)pyrimidine-4,6-diamine IUPAC Name: 6-N-(2-methylpropyl)-2-methylsulfanyl-4-N-(2,4,6-trichlorophenyl)pyrimidine-4,6-diamine Traditional Name: isobutyl-[2-(methylthio)-6-(2,4,6-trichloroanilino)pyrimidin-4-yl]amine Formula: C15H17Cl3N4S MolecularWeight: 391.74628

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC1=NC(=NC(=C1)NC2=C(C=C(C=C2Cl)Cl)Cl)SC

Isomeric SMILES

CC(C)CNC1=NC(=NC(=C1)NC2=C(C=C(C=C2Cl)Cl)Cl)SC

InChI

InChI=1S/C15H17Cl3N4S/c1-8(2)7-19-12-6-13(22-15(21-12)23-3)20-14-10(17)4-9(16)5-11(14)18/h4-6,8H,7H2,1-3H3,(H2,19,20,21,22)