6-methyl-3-[2-oxidanylidene-2-[(4-phenoxyphenyl)amino]ethyl]sulfanyl-1,2,4-triazin-5-olate

Systemtic Name: 6-methyl-3-[2-oxidanylidene-2-[(4-phenoxyphenyl)amino]ethyl]sulfanyl-1,2,4-triazin-5-olate Openeye Name: 6-methyl-3-[2-oxo-2-(4-phenoxyanilino)ethyl]sulfanyl-1,2,4-triazin-5-olate CAS Name: 6-methyl-3-[[2-oxo-2-(4-phenoxyanilino)ethyl]thio]-1,2,4-triazin-5-olate IUPAC Name: 6-methyl-3-[2-oxo-2-(4-phenoxyanilino)ethyl]sulfanyl-1,2,4-triazin-5-olate Traditional Name: 3-[[2-keto-2-(4-phenoxyanilino)ethyl]thio]-6-methyl-1,2,4-triazin-5-olate Formula: C18H15N4O3S- MolecularWeight: 367.4017

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(N=N1)SCC(=O)NC2=CC=C(C=C2)OC3=CC=CC=C3)[O-]

Isomeric SMILES

CC1=C(N=C(N=N1)SCC(=O)NC2=CC=C(C=C2)OC3=CC=CC=C3)[O-]

InChI

InChI=1S/C18H16N4O3S/c1-12-17(24)20-18(22-21-12)26-11-16(23)19-13-7-9-15(10-8-13)25-14-5-3-2-4-6-14/h2-10H,11H2,1H3,(H,19,23)(H,20,22,24)/p-1