6-(3-oxidanylidene-3-phenylazanyl-propyl)-3-sulfanylidene-2H-1,2,4-triazin-5-olate

Systemtic Name: 6-(3-oxidanylidene-3-phenylazanyl-propyl)-3-sulfanylidene-2H-1,2,4-triazin-5-olate Openeye Name: 6-(3-anilino-3-oxo-propyl)-3-thioxo-2H-1,2,4-triazin-5-olate CAS Name: 6-(3-anilino-3-oxopropyl)-3-sulfanylidene-2H-1,2,4-triazin-5-olate IUPAC Name: 6-(3-anilino-3-oxopropyl)-3-sulfanylidene-2H-1,2,4-triazin-5-olate Traditional Name: 6-(3-anilino-3-keto-propyl)-3-thioxo-2H-1,2,4-triazin-5-olate Formula: C12H11N4O2S- MolecularWeight: 275.30634

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)CCC2=NNC(=S)N=C2[O-]

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)CCC2=NNC(=S)N=C2[O-]

InChI

InChI=1S/C12H12N4O2S/c17-10(13-8-4-2-1-3-5-8)7-6-9-11(18)14-12(19)16-15-9/h1-5H,6-7H2,(H,13,17)(H2,14,16,18,19)/p-1