3-(2-bromanyl-4-propan-2-yl-phenyl)-5-methyl-7-piperidin-1-yl-[1,2,3]triazolo[4,5-d]pyrimidine

Systemtic Name: 3-(2-bromanyl-4-propan-2-yl-phenyl)-5-methyl-7-piperidin-1-yl-[1,2,3]triazolo[4,5-d]pyrimidine Openeye Name: 3-(2-bromo-4-isopropyl-phenyl)-5-methyl-7-(1-piperidyl)triazolo[4,5-d]pyrimidine CAS Name: 3-(2-bromo-4-propan-2-ylphenyl)-5-methyl-7-(1-piperidinyl)triazolo[4,5-d]pyrimidine IUPAC Name: 3-(2-bromo-4-propan-2-ylphenyl)-5-methyl-7-piperidin-1-yltriazolo[4,5-d]pyrimidine Traditional Name: 3-(2-bromo-4-isopropyl-phenyl)-5-methyl-7-piperidino-triazolo[4,5-d]pyrimidine Formula: C19H23BrN6 MolecularWeight: 415.33012

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(=N1)N3CCCCC3)N=NN2C4=C(C=C(C=C4)C(C)C)Br

Isomeric SMILES

CC1=NC2=C(C(=N1)N3CCCCC3)N=NN2C4=C(C=C(C=C4)C(C)C)Br

InChI

InChI=1S/C19H23BrN6/c1-12(2)14-7-8-16(15(20)11-14)26-19-17(23-24-26)18(21-13(3)22-19)25-9-5-4-6-10-25/h7-8,11-12H,4-6,9-10H2,1-3H3