3-(2-oxidanylidene-2-phenylazanyl-ethyl)sulfanyl-6-phenyl-1,2,4-triazin-5-olate

Systemtic Name: 3-(2-oxidanylidene-2-phenylazanyl-ethyl)sulfanyl-6-phenyl-1,2,4-triazin-5-olate Openeye Name: 3-(2-anilino-2-oxo-ethyl)sulfanyl-6-phenyl-1,2,4-triazin-5-olate CAS Name: 3-[(2-anilino-2-oxoethyl)thio]-6-phenyl-1,2,4-triazin-5-olate IUPAC Name: 3-(2-anilino-2-oxoethyl)sulfanyl-6-phenyl-1,2,4-triazin-5-olate Traditional Name: 3-[(2-anilino-2-keto-ethyl)thio]-6-phenyl-1,2,4-triazin-5-olate Formula: C17H13N4O2S- MolecularWeight: 337.37572

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(N=C(N=N2)SCC(=O)NC3=CC=CC=C3)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=C(N=C(N=N2)SCC(=O)NC3=CC=CC=C3)[O-]

InChI

InChI=1S/C17H14N4O2S/c22-14(18-13-9-5-2-6-10-13)11-24-17-19-16(23)15(20-21-17)12-7-3-1-4-8-12/h1-10H,11H2,(H,18,22)(H,19,21,23)/p-1