5-butyl-3-(phenylmethyl)-[1,2,3]triazolo[4,5-d]pyrimidin-7-amine

Systemtic Name: 5-butyl-3-(phenylmethyl)-[1,2,3]triazolo[4,5-d]pyrimidin-7-amine Openeye Name: 3-benzyl-5-butyl-triazolo[4,5-d]pyrimidin-7-amine CAS Name: 5-butyl-3-(phenylmethyl)-7-triazolo[4,5-d]pyrimidinamine IUPAC Name: 3-benzyl-5-butyltriazolo[4,5-d]pyrimidin-7-amine Traditional Name: (3-benzyl-5-butyl-triazolo[4,5-d]pyrimidin-7-yl)amine Formula: C15H18N6 MolecularWeight: 282.34362

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=C(C(=N1)N)N=NN2CC3=CC=CC=C3

Isomeric SMILES

CCCCC1=NC2=C(C(=N1)N)N=NN2CC3=CC=CC=C3

InChI

InChI=1S/C15H18N6/c1-2-3-9-12-17-14(16)13-15(18-12)21(20-19-13)10-11-7-5-4-6-8-11/h4-8H,2-3,9-10H2,1H3,(H2,16,17,18)