3-(2-bromanyl-6-methoxy-4-methylsulfanyl-phenyl)-N-butyl-N-ethyl-5-methyl-[1,2,3]triazolo[4,5-d]pyrimidin-7-amine

Systemtic Name: 3-(2-bromanyl-6-methoxy-4-methylsulfanyl-phenyl)-N-butyl-N-ethyl-5-methyl-[1,2,3]triazolo[4,5-d]pyrimidin-7-amine Openeye Name: 3-(2-bromo-6-methoxy-4-methylsulfanyl-phenyl)-N-butyl-N-ethyl-5-methyl-triazolo[4,5-d]pyrimidin-7-amine CAS Name: 3-[2-bromo-6-methoxy-4-(methylthio)phenyl]-N-butyl-N-ethyl-5-methyl-7-triazolo[4,5-d]pyrimidinamine IUPAC Name: 3-(2-bromo-6-methoxy-4-methylsulfanylphenyl)-N-butyl-N-ethyl-5-methyltriazolo[4,5-d]pyrimidin-7-amine Traditional Name: [3-[2-bromo-6-methoxy-4-(methylthio)phenyl]-5-methyl-triazolo[4,5-d]pyrimidin-7-yl]-butyl-ethyl-amine Formula: C19H25BrN6OS MolecularWeight: 465.4104

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC)C1=NC(=NC2=C1N=NN2C3=C(C=C(C=C3OC)SC)Br)C

Isomeric SMILES

CCCCN(CC)C1=NC(=NC2=C1N=NN2C3=C(C=C(C=C3OC)SC)Br)C

InChI

InChI=1S/C19H25BrN6OS/c1-6-8-9-25(7-2)18-16-19(22-12(3)21-18)26(24-23-16)17-14(20)10-13(28-5)11-15(17)27-4/h10-11H,6-9H2,1-5H3