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

Systemtic Name: 3-[2-[(3,4-dichlorophenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-6-phenyl-1,2,4-triazin-5-olate Openeye Name: 3-[2-(3,4-dichloroanilino)-2-oxo-ethyl]sulfanyl-6-phenyl-1,2,4-triazin-5-olate CAS Name: 3-[[2-(3,4-dichloroanilino)-2-oxoethyl]thio]-6-phenyl-1,2,4-triazin-5-olate IUPAC Name: 3-[2-(3,4-dichloroanilino)-2-oxoethyl]sulfanyl-6-phenyl-1,2,4-triazin-5-olate Traditional Name: 3-[[2-(3,4-dichloroanilino)-2-keto-ethyl]thio]-6-phenyl-1,2,4-triazin-5-olate Formula: C17H11Cl2N4O2S- MolecularWeight: 406.26584

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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(=C(C=C3)Cl)Cl)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C17H12Cl2N4O2S/c18-12-7-6-11(8-13(12)19)20-14(24)9-26-17-21-16(25)15(22-23-17)10-4-2-1-3-5-10/h1-8H,9H2,(H,20,24)(H,21,23,25)/p-1