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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)CSC1=NC(=O)C(=NN1)CC2=CC=CC=C2

Isomeric SMILES

CCCOC(=O)CSC1=NC(=O)C(=NN1)CC2=CC=CC=C2

InChI

InChI=1S/C15H17N3O3S/c1-2-8-21-13(19)10-22-15-16-14(20)12(17-18-15)9-11-6-4-3-5-7-11/h3-7H,2,8-10H2,1H3,(H,16,18,20)