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

Systemtic Name: 3-[2-oxidanylidene-2-[(3-propoxycarbonylphenyl)amino]ethyl]sulfanyl-1,2,4-triazin-5-olate Openeye Name: 3-[2-oxo-2-(3-propoxycarbonylanilino)ethyl]sulfanyl-1,2,4-triazin-5-olate CAS Name: 3-[[2-oxo-2-[3-[oxo(propoxy)methyl]anilino]ethyl]thio]-1,2,4-triazin-5-olate IUPAC Name: 3-[2-oxo-2-(3-propoxycarbonylanilino)ethyl]sulfanyl-1,2,4-triazin-5-olate Traditional Name: 3-[[2-keto-2-(3-propoxycarbonylanilino)ethyl]thio]-1,2,4-triazin-5-olate Formula: C15H15N4O4S- MolecularWeight: 347.369

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H16N4O4S/c1-2-6-23-14(22)10-4-3-5-11(7-10)17-13(21)9-24-15-18-12(20)8-16-19-15/h3-5,7-8H,2,6,9H2,1H3,(H,17,21)(H,18,19,20)/p-1