N4-(3,5-dimethylphenyl)-N6-(4-iodophenyl)pyrimidine-4,5,6-triamine

Systemtic Name: N4-(3,5-dimethylphenyl)-N6-(4-iodophenyl)pyrimidine-4,5,6-triamine Openeye Name: N4-(3,5-dimethylphenyl)-N6-(4-iodophenyl)pyrimidine-4,5,6-triamine CAS Name: N4-(3,5-dimethylphenyl)-N6-(4-iodophenyl)pyrimidine-4,5,6-triamine IUPAC Name: 4-N-(3,5-dimethylphenyl)-6-N-(4-iodophenyl)pyrimidine-4,5,6-triamine Traditional Name: [5-amino-6-(3,5-dimethylanilino)pyrimidin-4-yl]-(4-iodophenyl)amine Formula: C18H18IN5 MolecularWeight: 431.27349

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC2=NC=NC(=C2N)NC3=CC=C(C=C3)I)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC2=NC=NC(=C2N)NC3=CC=C(C=C3)I)C

InChI

InChI=1S/C18H18IN5/c1-11-7-12(2)9-15(8-11)24-18-16(20)17(21-10-22-18)23-14-5-3-13(19)4-6-14/h3-10H,20H2,1-2H3,(H2,21,22,23,24)