4-[(E)-(3-bromanyl-4-methoxy-phenyl)methylideneamino]-3-ethyl-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-[(E)-(3-bromanyl-4-methoxy-phenyl)methylideneamino]-3-ethyl-1H-1,2,4-triazole-5-thione Openeye Name: 4-[(E)-(3-bromo-4-methoxy-phenyl)methyleneamino]-3-ethyl-1H-1,2,4-triazole-5-thione CAS Name: 4-[(E)-(3-bromo-4-methoxyphenyl)methylideneamino]-3-ethyl-1H-1,2,4-triazole-5-thione IUPAC Name: 4-[(E)-(3-bromo-4-methoxyphenyl)methylideneamino]-3-ethyl-1H-1,2,4-triazole-5-thione Traditional Name: 4-[(E)-(3-bromo-4-methoxy-benzylidene)amino]-3-ethyl-1H-1,2,4-triazole-5-thione Formula: C12H13BrN4OS MolecularWeight: 341.22682

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NNC(=S)N1N=CC2=CC(=C(C=C2)OC)Br

Isomeric SMILES

CCC1=NNC(=S)N1/N=C/C2=CC(=C(C=C2)OC)Br

InChI

InChI=1S/C12H13BrN4OS/c1-3-11-15-16-12(19)17(11)14-7-8-4-5-10(18-2)9(13)6-8/h4-7H,3H2,1-2H3,(H,16,19)/b14-7+