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

Systemtic Name: N6-(4-iodophenyl)-N4-(3-methoxyphenyl)pyrimidine-4,5,6-triamine Openeye Name: N6-(4-iodophenyl)-N4-(3-methoxyphenyl)pyrimidine-4,5,6-triamine CAS Name: N6-(4-iodophenyl)-N4-(3-methoxyphenyl)pyrimidine-4,5,6-triamine IUPAC Name: 6-N-(4-iodophenyl)-4-N-(3-methoxyphenyl)pyrimidine-4,5,6-triamine Traditional Name: [5-amino-6-(4-iodoanilino)pyrimidin-4-yl]-(3-methoxyphenyl)amine Formula: C17H16IN5O MolecularWeight: 433.24631

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC2=NC=NC(=C2N)NC3=CC=C(C=C3)I

Isomeric SMILES

COC1=CC=CC(=C1)NC2=NC=NC(=C2N)NC3=CC=C(C=C3)I

InChI

InChI=1S/C17H16IN5O/c1-24-14-4-2-3-13(9-14)23-17-15(19)16(20-10-21-17)22-12-7-5-11(18)6-8-12/h2-10H,19H2,1H3,(H2,20,21,22,23)