2-[4-[(Z)-(3-methyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)iminomethyl]phenoxy]ethanoate

Systemtic Name: 2-[4-[(Z)-(3-methyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)iminomethyl]phenoxy]ethanoate Openeye Name: 2-[4-[(Z)-(3-methyl-5-thioxo-1H-1,2,4-triazol-4-yl)iminomethyl]phenoxy]acetate CAS Name: 2-[4-[(Z)-(3-methyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)iminomethyl]phenoxy]acetate IUPAC Name: 2-[4-[(Z)-(3-methyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)iminomethyl]phenoxy]acetate Traditional Name: 2-[4-[(Z)-(3-methyl-5-thioxo-1H-1,2,4-triazol-4-yl)iminomethyl]phenoxy]acetate Formula: C12H11N4O3S- MolecularWeight: 291.30574

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NNC(=S)N1N=CC2=CC=C(C=C2)OCC(=O)[O-]

Isomeric SMILES

CC1=NNC(=S)N1/N=C\C2=CC=C(C=C2)OCC(=O)[O-]

InChI

InChI=1S/C12H12N4O3S/c1-8-14-15-12(20)16(8)13-6-9-2-4-10(5-3-9)19-7-11(17)18/h2-6H,7H2,1H3,(H,15,20)(H,17,18)/p-1/b13-6-