4-[(E)-(2,3-dimethoxyphenyl)methylideneamino]-3-pyridin-3-yl-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-[(E)-(2,3-dimethoxyphenyl)methylideneamino]-3-pyridin-3-yl-1H-1,2,4-triazole-5-thione Openeye Name: 4-[(E)-(2,3-dimethoxyphenyl)methyleneamino]-3-(3-pyridyl)-1H-1,2,4-triazole-5-thione CAS Name: 4-[(E)-(2,3-dimethoxyphenyl)methylideneamino]-3-(3-pyridinyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 4-[(E)-(2,3-dimethoxyphenyl)methylideneamino]-3-pyridin-3-yl-1H-1,2,4-triazole-5-thione Traditional Name: 4-[(E)-(2,3-dimethoxybenzylidene)amino]-3-(3-pyridyl)-1H-1,2,4-triazole-5-thione Formula: C16H15N5O2S MolecularWeight: 341.3876

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)C=NN2C(=NNC2=S)C3=CN=CC=C3

Isomeric SMILES

COC1=CC=CC(=C1OC)/C=N/N2C(=NNC2=S)C3=CN=CC=C3

InChI

InChI=1S/C16H15N5O2S/c1-22-13-7-3-5-11(14(13)23-2)10-18-21-15(19-20-16(21)24)12-6-4-8-17-9-12/h3-10H,1-2H3,(H,20,24)/b18-10+