6-[4-(1-adamantyl)piperazin-1-yl]pyrimidine-2,4-diamine

Systemtic Name: 6-[4-(1-adamantyl)piperazin-1-yl]pyrimidine-2,4-diamine Openeye Name: 6-[4-(1-adamantyl)piperazin-1-yl]pyrimidine-2,4-diamine CAS Name: 6-[4-(1-adamantyl)-1-piperazinyl]pyrimidine-2,4-diamine IUPAC Name: 6-[4-(1-adamantyl)piperazin-1-yl]pyrimidine-2,4-diamine Traditional Name: [4-[4-(1-adamantyl)piperazino]-6-amino-pyrimidin-2-yl]amine Formula: C18H28N6 MolecularWeight: 328.45512

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC(=NC(=N2)N)N)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

C1CN(CCN1C2=CC(=NC(=N2)N)N)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C18H28N6/c19-15-8-16(22-17(20)21-15)23-1-3-24(4-2-23)18-9-12-5-13(10-18)7-14(6-12)11-18/h8,12-14H,1-7,9-11H2,(H4,19,20,21,22)