6-chloranyl-N4-octyl-pyrimidine-2,4,5-triamine

Systemtic Name: 6-chloranyl-N4-octyl-pyrimidine-2,4,5-triamine Openeye Name: 6-chloro-N4-octyl-pyrimidine-2,4,5-triamine CAS Name: 6-chloro-N4-octylpyrimidine-2,4,5-triamine IUPAC Name: 6-chloro-4-N-octylpyrimidine-2,4,5-triamine Traditional Name: (2,5-diamino-6-chloro-pyrimidin-4-yl)-octyl-amine Formula: C12H22ClN5 MolecularWeight: 271.78958

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCNC1=C(C(=NC(=N1)N)Cl)N

Isomeric SMILES

CCCCCCCCNC1=C(C(=NC(=N1)N)Cl)N

InChI

InChI=1S/C12H22ClN5/c1-2-3-4-5-6-7-8-16-11-9(14)10(13)17-12(15)18-11/h2-8,14H2,1H3,(H3,15,16,17,18)