N-[(3-bromanyl-4,5-diethoxy-phenyl)methyl]-1,2,4-triazol-4-amine

Systemtic Name: N-[(3-bromanyl-4,5-diethoxy-phenyl)methyl]-1,2,4-triazol-4-amine Openeye Name: N-[(3-bromo-4,5-diethoxy-phenyl)methyl]-1,2,4-triazol-4-amine CAS Name: N-[(3-bromo-4,5-diethoxyphenyl)methyl]-1,2,4-triazol-4-amine IUPAC Name: N-[(3-bromo-4,5-diethoxyphenyl)methyl]-1,2,4-triazol-4-amine Traditional Name: (3-bromo-4,5-diethoxy-benzyl)-(1,2,4-triazol-4-yl)amine Formula: C13H17BrN4O2 MolecularWeight: 341.20368

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)CNN2C=NN=C2)Br)OCC

Isomeric SMILES

CCOC1=C(C(=CC(=C1)CNN2C=NN=C2)Br)OCC

InChI

InChI=1S/C13H17BrN4O2/c1-3-19-12-6-10(5-11(14)13(12)20-4-2)7-17-18-8-15-16-9-18/h5-6,8-9,17H,3-4,7H2,1-2H3