4-azanyl-6-[2-(1,3-benzodioxol-5-yl)ethenyl]-3-methylsulfanyl-1,2,4-triazin-5-one

Systemtic Name: 4-azanyl-6-[2-(1,3-benzodioxol-5-yl)ethenyl]-3-methylsulfanyl-1,2,4-triazin-5-one Openeye Name: 4-amino-6-[2-(1,3-benzodioxol-5-yl)vinyl]-3-methylsulfanyl-1,2,4-triazin-5-one CAS Name: 4-amino-6-[2-(1,3-benzodioxol-5-yl)ethenyl]-3-(methylthio)-1,2,4-triazin-5-one IUPAC Name: 4-amino-6-[2-(1,3-benzodioxol-5-yl)ethenyl]-3-methylsulfanyl-1,2,4-triazin-5-one Traditional Name: 4-amino-6-[2-(1,3-benzodioxol-5-yl)vinyl]-3-(methylthio)-1,2,4-triazin-5-one Formula: C13H12N4O3S MolecularWeight: 304.32438

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=NN=C(C(=O)N1N)C=CC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CSC1=NN=C(C(=O)N1N)C=CC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C13H12N4O3S/c1-21-13-16-15-9(12(18)17(13)14)4-2-8-3-5-10-11(6-8)20-7-19-10/h2-6H,7,14H2,1H3