N-(4-bromanyl-3-methyl-phenyl)-3-ethyl-[1,2,3]triazolo[4,5-d]pyrimidin-7-amine

Systemtic Name: N-(4-bromanyl-3-methyl-phenyl)-3-ethyl-[1,2,3]triazolo[4,5-d]pyrimidin-7-amine Openeye Name: N-(4-bromo-3-methyl-phenyl)-3-ethyl-triazolo[4,5-d]pyrimidin-7-amine CAS Name: N-(4-bromo-3-methylphenyl)-3-ethyl-7-triazolo[4,5-d]pyrimidinamine IUPAC Name: N-(4-bromo-3-methylphenyl)-3-ethyltriazolo[4,5-d]pyrimidin-7-amine Traditional Name: (4-bromo-3-methyl-phenyl)-(3-ethyltriazolo[4,5-d]pyrimidin-7-yl)amine Formula: C13H13BrN6 MolecularWeight: 333.18652

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C(=NC=N2)NC3=CC(=C(C=C3)Br)C)N=N1

Isomeric SMILES

CCN1C2=C(C(=NC=N2)NC3=CC(=C(C=C3)Br)C)N=N1

InChI

InChI=1S/C13H13BrN6/c1-3-20-13-11(18-19-20)12(15-7-16-13)17-9-4-5-10(14)8(2)6-9/h4-7H,3H2,1-2H3,(H,15,16,17)