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

Systemtic Name: N-(2-bromanyl-4-propan-2-yl-phenyl)-5-methyl-3-propyl-[1,2,3]triazolo[4,5-d]pyrimidin-7-amine Openeye Name: N-(2-bromo-4-isopropyl-phenyl)-5-methyl-3-propyl-triazolo[4,5-d]pyrimidin-7-amine CAS Name: N-(2-bromo-4-propan-2-ylphenyl)-5-methyl-3-propyl-7-triazolo[4,5-d]pyrimidinamine IUPAC Name: N-(2-bromo-4-propan-2-ylphenyl)-5-methyl-3-propyltriazolo[4,5-d]pyrimidin-7-amine Traditional Name: (2-bromo-4-isopropyl-phenyl)-(5-methyl-3-propyl-triazolo[4,5-d]pyrimidin-7-yl)amine Formula: C17H21BrN6 MolecularWeight: 389.29284

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C(=NC(=N2)C)NC3=C(C=C(C=C3)C(C)C)Br)N=N1

Isomeric SMILES

CCCN1C2=C(C(=NC(=N2)C)NC3=C(C=C(C=C3)C(C)C)Br)N=N1

InChI

InChI=1S/C17H21BrN6/c1-5-8-24-17-15(22-23-24)16(19-11(4)20-17)21-14-7-6-12(10(2)3)9-13(14)18/h6-7,9-10H,5,8H2,1-4H3,(H,19,20,21)