3-[2-[(5-chloranyl-2-oxidanyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-6-phenyl-1,2,4-triazin-5-olate

Systemtic Name: 3-[2-[(5-chloranyl-2-oxidanyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-6-phenyl-1,2,4-triazin-5-olate Openeye Name: 3-[2-(5-chloro-2-hydroxy-anilino)-2-oxo-ethyl]sulfanyl-6-phenyl-1,2,4-triazin-5-olate CAS Name: 3-[[2-(5-chloro-2-hydroxyanilino)-2-oxoethyl]thio]-6-phenyl-1,2,4-triazin-5-olate IUPAC Name: 3-[2-(5-chloro-2-hydroxyanilino)-2-oxoethyl]sulfanyl-6-phenyl-1,2,4-triazin-5-olate Traditional Name: 3-[[2-(5-chloro-2-hydroxy-anilino)-2-keto-ethyl]thio]-6-phenyl-1,2,4-triazin-5-olate Formula: C17H12ClN4O3S- MolecularWeight: 387.82018

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H13ClN4O3S/c18-11-6-7-13(23)12(8-11)19-14(24)9-26-17-20-16(25)15(21-22-17)10-4-2-1-3-5-10/h1-8,23H,9H2,(H,19,24)(H,20,22,25)/p-1