[4-[(Z)-(3-tert-butyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)iminomethyl]-2-methoxy-phenyl] ethanoate

Systemtic Name: [4-[(Z)-(3-tert-butyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)iminomethyl]-2-methoxy-phenyl] ethanoate Openeye Name: [4-[(Z)-(3-tert-butyl-5-thioxo-1H-1,2,4-triazol-4-yl)iminomethyl]-2-methoxy-phenyl] acetate CAS Name: acetic acid [4-[(Z)-(3-tert-butyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)iminomethyl]-2-methoxyphenyl] ester IUPAC Name: [4-[(Z)-(3-tert-butyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)iminomethyl]-2-methoxyphenyl] acetate Traditional Name: acetic acid [4-[(Z)-(3-tert-butyl-5-thioxo-1H-1,2,4-triazol-4-yl)iminomethyl]-2-methoxy-phenyl] ester Formula: C16H20N4O3S MolecularWeight: 348.42

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=C(C=C(C=C1)C=NN2C(=NNC2=S)C(C)(C)C)OC

Isomeric SMILES

CC(=O)OC1=C(C=C(C=C1)/C=N\N2C(=NNC2=S)C(C)(C)C)OC

InChI

InChI=1S/C16H20N4O3S/c1-10(21)23-12-7-6-11(8-13(12)22-5)9-17-20-14(16(2,3)4)18-19-15(20)24/h6-9H,1-5H3,(H,19,24)/b17-9-