4-[(Z)-(3-chloranyl-5-methoxy-4-prop-2-ynoxy-phenyl)methylideneamino]-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-[(Z)-(3-chloranyl-5-methoxy-4-prop-2-ynoxy-phenyl)methylideneamino]-1H-1,2,4-triazole-5-thione Openeye Name: 4-[(Z)-(3-chloro-5-methoxy-4-prop-2-ynoxy-phenyl)methyleneamino]-1H-1,2,4-triazole-5-thione CAS Name: 4-[(Z)-(3-chloro-5-methoxy-4-prop-2-ynoxyphenyl)methylideneamino]-1H-1,2,4-triazole-5-thione IUPAC Name: 4-[(Z)-(3-chloro-5-methoxy-4-prop-2-ynoxyphenyl)methylideneamino]-1H-1,2,4-triazole-5-thione Traditional Name: 4-[(Z)-(3-chloro-5-methoxy-4-propargyloxy-benzylidene)amino]-1H-1,2,4-triazole-5-thione Formula: C13H11ClN4O2S MolecularWeight: 322.77004

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=NN2C=NNC2=S)Cl)OCC#C

Isomeric SMILES

COC1=C(C(=CC(=C1)/C=N\N2C=NNC2=S)Cl)OCC#C

InChI

InChI=1S/C13H11ClN4O2S/c1-3-4-20-12-10(14)5-9(6-11(12)19-2)7-16-18-8-15-17-13(18)21/h1,5-8H,4H2,2H3,(H,17,21)/b16-7-