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

Systemtic Name: 4-[(E)-(3-bromanyl-4-methoxy-phenyl)methylideneamino]-3-(3-phenyl-1H-pyrazol-5-yl)-1H-1,2,4-triazole-5-thione Openeye Name: 4-[(E)-(3-bromo-4-methoxy-phenyl)methyleneamino]-3-(3-phenyl-1H-pyrazol-5-yl)-1H-1,2,4-triazole-5-thione CAS Name: 4-[(E)-(3-bromo-4-methoxyphenyl)methylideneamino]-3-(3-phenyl-1H-pyrazol-5-yl)-1H-1,2,4-triazole-5-thione IUPAC Name: 4-[(E)-(3-bromo-4-methoxyphenyl)methylideneamino]-3-(3-phenyl-1H-pyrazol-5-yl)-1H-1,2,4-triazole-5-thione Traditional Name: 4-[(E)-(3-bromo-4-methoxy-benzylidene)amino]-3-(3-phenyl-1H-pyrazol-5-yl)-1H-1,2,4-triazole-5-thione Formula: C19H15BrN6OS MolecularWeight: 455.331

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=NN2C(=NNC2=S)C3=CC(=NN3)C4=CC=CC=C4)Br

Isomeric SMILES

COC1=C(C=C(C=C1)/C=N/N2C(=NNC2=S)C3=CC(=NN3)C4=CC=CC=C4)Br

InChI

InChI=1S/C19H15BrN6OS/c1-27-17-8-7-12(9-14(17)20)11-21-26-18(24-25-19(26)28)16-10-15(22-23-16)13-5-3-2-4-6-13/h2-11H,1H3,(H,22,23)(H,25,28)/b21-11+