4-[(5-methylsulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl)methoxy]-2H-phthalazin-1-one

Systemtic Name: 4-[(5-methylsulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl)methoxy]-2H-phthalazin-1-one Openeye Name: 4-[(4-allyl-5-methylsulfanyl-1,2,4-triazol-3-yl)methoxy]-2H-phthalazin-1-one CAS Name: 4-[[5-(methylthio)-4-prop-2-enyl-1,2,4-triazol-3-yl]methoxy]-2H-phthalazin-1-one IUPAC Name: 4-[(5-methylsulfanyl-4-prop-2-enyl-1,2,4-triazol-3-yl)methoxy]-2H-phthalazin-1-one Traditional Name: 4-[[4-allyl-5-(methylthio)-1,2,4-triazol-3-yl]methoxy]-2H-phthalazin-1-one Formula: C15H15N5O2S MolecularWeight: 329.3769

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NN=C(N1CC=C)COC2=NNC(=O)C3=CC=CC=C32

Isomeric SMILES

CSC1=NN=C(N1CC=C)COC2=NNC(=O)C3=CC=CC=C32

InChI

InChI=1S/C15H15N5O2S/c1-3-8-20-12(16-19-15(20)23-2)9-22-14-11-7-5-4-6-10(11)13(21)17-18-14/h3-7H,1,8-9H2,2H3,(H,17,21)