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

Systemtic Name: 3-[(2-bromanyl-4,5-diethoxy-phenyl)methylsulfanyl]-1,2,4-triazol-4-amine Openeye Name: 3-[(2-bromo-4,5-diethoxy-phenyl)methylsulfanyl]-1,2,4-triazol-4-amine CAS Name: 3-[(2-bromo-4,5-diethoxyphenyl)methylthio]-1,2,4-triazol-4-amine IUPAC Name: 3-[(2-bromo-4,5-diethoxyphenyl)methylsulfanyl]-1,2,4-triazol-4-amine Traditional Name: [3-[(2-bromo-4,5-diethoxy-benzyl)thio]-1,2,4-triazol-4-yl]amine Formula: C13H17BrN4O2S MolecularWeight: 373.26868

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C(=C1)CSC2=NN=CN2N)Br)OCC

Isomeric SMILES

CCOC1=C(C=C(C(=C1)CSC2=NN=CN2N)Br)OCC

InChI

InChI=1S/C13H17BrN4O2S/c1-3-19-11-5-9(10(14)6-12(11)20-4-2)7-21-13-17-16-8-18(13)15/h5-6,8H,3-4,7,15H2,1-2H3