[2-methoxy-4-[(E)-(6-methyl-5-oxidanylidene-3-sulfanylidene-2H-1,2,4-triazin-4-yl)iminomethyl]phenyl] benzoate

Systemtic Name: [2-methoxy-4-[(E)-(6-methyl-5-oxidanylidene-3-sulfanylidene-2H-1,2,4-triazin-4-yl)iminomethyl]phenyl] benzoate Openeye Name: [2-methoxy-4-[(E)-(6-methyl-5-oxo-3-thioxo-2H-1,2,4-triazin-4-yl)iminomethyl]phenyl] benzoate CAS Name: benzoic acid [2-methoxy-4-[(E)-(6-methyl-5-oxo-3-sulfanylidene-2H-1,2,4-triazin-4-yl)iminomethyl]phenyl] ester IUPAC Name: [2-methoxy-4-[(E)-(6-methyl-5-oxo-3-sulfanylidene-2H-1,2,4-triazin-4-yl)iminomethyl]phenyl] benzoate Traditional Name: benzoic acid [4-[(E)-(5-keto-6-methyl-3-thioxo-2H-1,2,4-triazin-4-yl)iminomethyl]-2-methoxy-phenyl] ester Formula: C19H16N4O4S MolecularWeight: 396.41974

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NNC(=S)N(C1=O)N=CC2=CC(=C(C=C2)OC(=O)C3=CC=CC=C3)OC

Isomeric SMILES

CC1=NNC(=S)N(C1=O)/N=C/C2=CC(=C(C=C2)OC(=O)C3=CC=CC=C3)OC

InChI

InChI=1S/C19H16N4O4S/c1-12-17(24)23(19(28)22-21-12)20-11-13-8-9-15(16(10-13)26-2)27-18(25)14-6-4-3-5-7-14/h3-11H,1-2H3,(H,22,28)/b20-11+