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

Systemtic Name: 4-[(E)-(3-bromanyl-4-methoxy-phenyl)methylideneamino]-3-butyl-1H-1,2,4-triazole-5-thione Openeye Name: 4-[(E)-(3-bromo-4-methoxy-phenyl)methyleneamino]-3-butyl-1H-1,2,4-triazole-5-thione CAS Name: 4-[(E)-(3-bromo-4-methoxyphenyl)methylideneamino]-3-butyl-1H-1,2,4-triazole-5-thione IUPAC Name: 4-[(E)-(3-bromo-4-methoxyphenyl)methylideneamino]-3-butyl-1H-1,2,4-triazole-5-thione Traditional Name: 4-[(E)-(3-bromo-4-methoxy-benzylidene)amino]-3-butyl-1H-1,2,4-triazole-5-thione Formula: C14H17BrN4OS MolecularWeight: 369.27998

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NNC(=S)N1N=CC2=CC(=C(C=C2)OC)Br

Isomeric SMILES

CCCCC1=NNC(=S)N1/N=C/C2=CC(=C(C=C2)OC)Br

InChI

InChI=1S/C14H17BrN4OS/c1-3-4-5-13-17-18-14(21)19(13)16-9-10-6-7-12(20-2)11(15)8-10/h6-9H,3-5H2,1-2H3,(H,18,21)/b16-9+