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

Systemtic Name: 3-[2-[(4-iodophenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-1,2,4-triazin-5-olate Openeye Name: 3-[2-(4-iodoanilino)-2-oxo-ethyl]sulfanyl-1,2,4-triazin-5-olate CAS Name: 3-[[2-(4-iodoanilino)-2-oxoethyl]thio]-1,2,4-triazin-5-olate IUPAC Name: 3-[2-(4-iodoanilino)-2-oxoethyl]sulfanyl-1,2,4-triazin-5-olate Traditional Name: 3-[[2-(4-iodoanilino)-2-keto-ethyl]thio]-1,2,4-triazin-5-olate Formula: C11H8IN4O2S- MolecularWeight: 387.17629

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=O)CSC2=NC(=CN=N2)[O-])I

Isomeric SMILES

C1=CC(=CC=C1NC(=O)CSC2=NC(=CN=N2)[O-])I

InChI

InChI=1S/C11H9IN4O2S/c12-7-1-3-8(4-2-7)14-10(18)6-19-11-15-9(17)5-13-16-11/h1-5H,6H2,(H,14,18)(H,15,16,17)/p-1