5-[3-(4-azanyl-2-chloranyl-phenoxy)propyl]pyrimidine-2,4,6-triamine

Systemtic Name: 5-[3-(4-azanyl-2-chloranyl-phenoxy)propyl]pyrimidine-2,4,6-triamine Openeye Name: 5-[3-(4-amino-2-chloro-phenoxy)propyl]pyrimidine-2,4,6-triamine CAS Name: 5-[3-(4-amino-2-chlorophenoxy)propyl]pyrimidine-2,4,6-triamine IUPAC Name: 5-[3-(4-amino-2-chlorophenoxy)propyl]pyrimidine-2,4,6-triamine Traditional Name: [3-chloro-4-[3-(2,4,6-triaminopyrimidin-5-yl)propoxy]phenyl]amine Formula: C13H17ClN6O MolecularWeight: 308.76668

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1N)Cl)OCCCC2=C(N=C(N=C2N)N)N

Isomeric SMILES

C1=CC(=C(C=C1N)Cl)OCCCC2=C(N=C(N=C2N)N)N

InChI

InChI=1S/C13H17ClN6O/c14-9-6-7(15)3-4-10(9)21-5-1-2-8-11(16)19-13(18)20-12(8)17/h3-4,6H,1-2,5,15H2,(H6,16,17,18,19,20)