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

Systemtic Name: 6-(2-aminophenyl)-3-[2-[(3-ethanoylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-1,2,4-triazin-5-olate Openeye Name: 3-[2-(3-acetylanilino)-2-oxo-ethyl]sulfanyl-6-(2-aminophenyl)-1,2,4-triazin-5-olate CAS Name: 3-[[2-(3-acetylanilino)-2-oxoethyl]thio]-6-(2-aminophenyl)-1,2,4-triazin-5-olate IUPAC Name: 3-[2-(3-acetylanilino)-2-oxoethyl]sulfanyl-6-(2-aminophenyl)-1,2,4-triazin-5-olate Traditional Name: 3-[[2-(3-acetylanilino)-2-keto-ethyl]thio]-6-(2-aminophenyl)-1,2,4-triazin-5-olate Formula: C19H16N5O3S- MolecularWeight: 394.42704

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)NC(=O)CSC2=NC(=C(N=N2)C3=CC=CC=C3N)[O-]

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)NC(=O)CSC2=NC(=C(N=N2)C3=CC=CC=C3N)[O-]

InChI

InChI=1S/C19H17N5O3S/c1-11(25)12-5-4-6-13(9-12)21-16(26)10-28-19-22-18(27)17(23-24-19)14-7-2-3-8-15(14)20/h2-9H,10,20H2,1H3,(H,21,26)(H,22,24,27)/p-1