N6-(3-methoxyphenyl)-N4-(4-methylpiperazin-1-yl)pyrimidine-4,5,6-triamine

Systemtic Name: N6-(3-methoxyphenyl)-N4-(4-methylpiperazin-1-yl)pyrimidine-4,5,6-triamine Openeye Name: N6-(3-methoxyphenyl)-N4-(4-methylpiperazin-1-yl)pyrimidine-4,5,6-triamine CAS Name: N6-(3-methoxyphenyl)-N4-(4-methyl-1-piperazinyl)pyrimidine-4,5,6-triamine IUPAC Name: 6-N-(3-methoxyphenyl)-4-N-(4-methylpiperazin-1-yl)pyrimidine-4,5,6-triamine Traditional Name: [5-amino-6-(m-anisidino)pyrimidin-4-yl]-(4-methylpiperazino)amine Formula: C16H23N7O MolecularWeight: 329.40012

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)NC2=NC=NC(=C2N)NC3=CC(=CC=C3)OC

Isomeric SMILES

CN1CCN(CC1)NC2=NC=NC(=C2N)NC3=CC(=CC=C3)OC

InChI

InChI=1S/C16H23N7O/c1-22-6-8-23(9-7-22)21-16-14(17)15(18-11-19-16)20-12-4-3-5-13(10-12)24-2/h3-5,10-11H,6-9,17H2,1-2H3,(H2,18,19,20,21)