[2,6-dimethoxy-4-[(3-pyridin-2-yl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)iminomethyl]phenyl] ethanoate

Systemtic Name: [2,6-dimethoxy-4-[(3-pyridin-2-yl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)iminomethyl]phenyl] ethanoate Openeye Name: [2,6-dimethoxy-4-[[3-(2-pyridyl)-5-thioxo-1H-1,2,4-triazol-4-yl]iminomethyl]phenyl] acetate CAS Name: acetic acid [2,6-dimethoxy-4-[[3-(2-pyridinyl)-5-sulfanylidene-1H-1,2,4-triazol-4-yl]iminomethyl]phenyl] ester IUPAC Name: [2,6-dimethoxy-4-[(3-pyridin-2-yl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)iminomethyl]phenyl] acetate Traditional Name: acetic acid [2,6-dimethoxy-4-[[3-(2-pyridyl)-5-thioxo-1H-1,2,4-triazol-4-yl]iminomethyl]phenyl] ester Formula: C18H17N5O4S MolecularWeight: 399.42368

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C=C(C=C1OC)C=NN2C(=NNC2=S)C3=CC=CC=N3)OC

Isomeric SMILES

CC(=O)OC1=C(C=C(C=C1OC)C=NN2C(=NNC2=S)C3=CC=CC=N3)OC

InChI

InChI=1S/C18H17N5O4S/c1-11(24)27-16-14(25-2)8-12(9-15(16)26-3)10-20-23-17(21-22-18(23)28)13-6-4-5-7-19-13/h4-10H,1-3H3,(H,22,28)