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

Systemtic Name: N-[[3-bromanyl-4-[(4-chlorophenyl)methoxy]-5-methoxy-phenyl]methyl]-1,2,4-triazol-4-amine Openeye Name: N-[[3-bromo-4-[(4-chlorophenyl)methoxy]-5-methoxy-phenyl]methyl]-1,2,4-triazol-4-amine CAS Name: N-[[3-bromo-4-[(4-chlorophenyl)methoxy]-5-methoxyphenyl]methyl]-1,2,4-triazol-4-amine IUPAC Name: N-[[3-bromo-4-[(4-chlorophenyl)methoxy]-5-methoxyphenyl]methyl]-1,2,4-triazol-4-amine Traditional Name: [3-bromo-4-(4-chlorobenzyl)oxy-5-methoxy-benzyl]-(1,2,4-triazol-4-yl)amine Formula: C17H16BrClN4O2 MolecularWeight: 423.69154

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)CNN2C=NN=C2)Br)OCC3=CC=C(C=C3)Cl

Isomeric SMILES

COC1=C(C(=CC(=C1)CNN2C=NN=C2)Br)OCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C17H16BrClN4O2/c1-24-16-7-13(8-22-23-10-20-21-11-23)6-15(18)17(16)25-9-12-2-4-14(19)5-3-12/h2-7,10-11,22H,8-9H2,1H3