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

Systemtic Name: 4-[(E)-(5-bromanyl-2-methoxy-phenyl)methylideneamino]-3-(3-ethoxyphenyl)-1H-1,2,4-triazole-5-thione Openeye Name: 4-[(E)-(5-bromo-2-methoxy-phenyl)methyleneamino]-3-(3-ethoxyphenyl)-1H-1,2,4-triazole-5-thione CAS Name: 4-[(E)-(5-bromo-2-methoxyphenyl)methylideneamino]-3-(3-ethoxyphenyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 4-[(E)-(5-bromo-2-methoxyphenyl)methylideneamino]-3-(3-ethoxyphenyl)-1H-1,2,4-triazole-5-thione Traditional Name: 4-[(E)-(5-bromo-2-methoxy-benzylidene)amino]-3-m-phenetyl-1H-1,2,4-triazole-5-thione Formula: C18H17BrN4O2S MolecularWeight: 433.32218

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)C2=NNC(=S)N2N=CC3=C(C=CC(=C3)Br)OC

Isomeric SMILES

CCOC1=CC=CC(=C1)C2=NNC(=S)N2/N=C/C3=C(C=CC(=C3)Br)OC

InChI

InChI=1S/C18H17BrN4O2S/c1-3-25-15-6-4-5-12(10-15)17-21-22-18(26)23(17)20-11-13-9-14(19)7-8-16(13)24-2/h4-11H,3H2,1-2H3,(H,22,26)/b20-11+