6-[(Z)-(3-ethyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)iminomethyl]-2,3-dimethoxy-benzoic acid

Systemtic Name: 6-[(Z)-(3-ethyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)iminomethyl]-2,3-dimethoxy-benzoic acid Openeye Name: 6-[(Z)-(3-ethyl-5-thioxo-1H-1,2,4-triazol-4-yl)iminomethyl]-2,3-dimethoxy-benzoic acid CAS Name: 6-[(Z)-(3-ethyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)iminomethyl]-2,3-dimethoxybenzoic acid IUPAC Name: 6-[(Z)-(3-ethyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)iminomethyl]-2,3-dimethoxybenzoic acid Traditional Name: 6-[(Z)-(3-ethyl-5-thioxo-1H-1,2,4-triazol-4-yl)iminomethyl]-2,3-dimethoxy-benzoic acid Formula: C14H16N4O4S MolecularWeight: 336.36624

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NNC(=S)N1N=CC2=C(C(=C(C=C2)OC)OC)C(=O)O

Isomeric SMILES

CCC1=NNC(=S)N1/N=C\C2=C(C(=C(C=C2)OC)OC)C(=O)O

InChI

InChI=1S/C14H16N4O4S/c1-4-10-16-17-14(23)18(10)15-7-8-5-6-9(21-2)12(22-3)11(8)13(19)20/h5-7H,4H2,1-3H3,(H,17,23)(H,19,20)/b15-7-