6-ethyl-5-(3-oxidanylbenzotriazol-5-yl)pyrimidine-2,4-diamine

Systemtic Name: 6-ethyl-5-(3-oxidanylbenzotriazol-5-yl)pyrimidine-2,4-diamine Openeye Name: 6-ethyl-5-(3-hydroxybenzotriazol-5-yl)pyrimidine-2,4-diamine CAS Name: 6-ethyl-5-(3-hydroxy-5-benzotriazolyl)pyrimidine-2,4-diamine IUPAC Name: 6-ethyl-5-(3-hydroxybenzotriazol-5-yl)pyrimidine-2,4-diamine Traditional Name: [2-amino-6-ethyl-5-(3-hydroxybenzotriazol-5-yl)pyrimidin-4-yl]amine Formula: C12H13N7O MolecularWeight: 271.27792

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NC(=N1)N)N)C2=CC3=C(C=C2)N=NN3O

Isomeric SMILES

CCC1=C(C(=NC(=N1)N)N)C2=CC3=C(C=C2)N=NN3O

InChI

InChI=1S/C12H13N7O/c1-2-7-10(11(13)16-12(14)15-7)6-3-4-8-9(5-6)19(20)18-17-8/h3-5,20H,2H2,1H3,(H4,13,14,15,16)