N6-(1-adamantyl)-N4-methyl-N4-(phenylmethyl)pyrimidine-4,5,6-triamine

Systemtic Name: N6-(1-adamantyl)-N4-methyl-N4-(phenylmethyl)pyrimidine-4,5,6-triamine Openeye Name: N6-(1-adamantyl)-N4-benzyl-N4-methyl-pyrimidine-4,5,6-triamine CAS Name: N6-(1-adamantyl)-N4-methyl-N4-(phenylmethyl)pyrimidine-4,5,6-triamine IUPAC Name: 6-N-(1-adamantyl)-4-N-benzyl-4-N-methylpyrimidine-4,5,6-triamine Traditional Name: [6-(1-adamantylamino)-5-amino-pyrimidin-4-yl]-benzyl-methyl-amine Formula: C22H29N5 MolecularWeight: 363.49916

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1)C2=NC=NC(=C2N)NC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CN(CC1=CC=CC=C1)C2=NC=NC(=C2N)NC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C22H29N5/c1-27(13-15-5-3-2-4-6-15)21-19(23)20(24-14-25-21)26-22-10-16-7-17(11-22)9-18(8-16)12-22/h2-6,14,16-18H,7-13,23H2,1H3,(H,24,25,26)