6-(1,3-benzodioxol-5-ylmethyl)-3-methylsulfanyl-4-phenyl-1,2,4-triazin-5-one

Systemtic Name: 6-(1,3-benzodioxol-5-ylmethyl)-3-methylsulfanyl-4-phenyl-1,2,4-triazin-5-one Openeye Name: 6-(1,3-benzodioxol-5-ylmethyl)-3-methylsulfanyl-4-phenyl-1,2,4-triazin-5-one CAS Name: 6-(1,3-benzodioxol-5-ylmethyl)-3-(methylthio)-4-phenyl-1,2,4-triazin-5-one IUPAC Name: 6-(1,3-benzodioxol-5-ylmethyl)-3-methylsulfanyl-4-phenyl-1,2,4-triazin-5-one Traditional Name: 3-(methylthio)-4-phenyl-6-piperonyl-1,2,4-triazin-5-one Formula: C18H15N3O3S MolecularWeight: 353.395

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NN=C(C(=O)N1C2=CC=CC=C2)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CSC1=NN=C(C(=O)N1C2=CC=CC=C2)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C18H15N3O3S/c1-25-18-20-19-14(17(22)21(18)13-5-3-2-4-6-13)9-12-7-8-15-16(10-12)24-11-23-15/h2-8,10H,9,11H2,1H3