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

Systemtic Name: 3-[2-oxidanylidene-2-[(4-propan-2-yloxyphenyl)amino]ethyl]sulfanyl-1,2,4-triazin-5-olate Openeye Name: 3-[2-(4-isopropoxyanilino)-2-oxo-ethyl]sulfanyl-1,2,4-triazin-5-olate CAS Name: 3-[[2-oxo-2-(4-propan-2-yloxyanilino)ethyl]thio]-1,2,4-triazin-5-olate IUPAC Name: 3-[2-oxo-2-(4-propan-2-yloxyanilino)ethyl]sulfanyl-1,2,4-triazin-5-olate Traditional Name: 3-[[2-(4-isopropoxyanilino)-2-keto-ethyl]thio]-1,2,4-triazin-5-olate Formula: C14H15N4O3S- MolecularWeight: 319.3589

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)NC(=O)CSC2=NC(=CN=N2)[O-]

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)NC(=O)CSC2=NC(=CN=N2)[O-]

InChI

InChI=1S/C14H16N4O3S/c1-9(2)21-11-5-3-10(4-6-11)16-13(20)8-22-14-17-12(19)7-15-18-14/h3-7,9H,8H2,1-2H3,(H,16,20)(H,17,18,19)/p-1