butyl 2-[(5-oxidanylidene-6-phenyl-2H-1,2,4-triazin-3-yl)sulfanyl]ethanoate

Systemtic Name: butyl 2-[(5-oxidanylidene-6-phenyl-2H-1,2,4-triazin-3-yl)sulfanyl]ethanoate Openeye Name: butyl 2-[(5-oxo-6-phenyl-2H-1,2,4-triazin-3-yl)sulfanyl]acetate CAS Name: 2-[(5-oxo-6-phenyl-2H-1,2,4-triazin-3-yl)thio]acetic acid butyl ester IUPAC Name: butyl 2-[(5-oxo-6-phenyl-2H-1,2,4-triazin-3-yl)sulfanyl]acetate Traditional Name: 2-[(5-keto-6-phenyl-2H-1,2,4-triazin-3-yl)thio]acetic acid butyl ester Formula: C15H17N3O3S MolecularWeight: 319.37878

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)CSC1=NC(=O)C(=NN1)C2=CC=CC=C2

Isomeric SMILES

CCCCOC(=O)CSC1=NC(=O)C(=NN1)C2=CC=CC=C2

InChI

InChI=1S/C15H17N3O3S/c1-2-3-9-21-12(19)10-22-15-16-14(20)13(17-18-15)11-7-5-4-6-8-11/h4-8H,2-3,9-10H2,1H3,(H,16,18,20)