methyl-[(5-methyl-1,2-oxazol-3-yl)methyl]-[(1-oxidanylidene-4-thiophen-2-yl-phthalazin-2-yl)methyl]azanium

Systemtic Name: methyl-[(5-methyl-1,2-oxazol-3-yl)methyl]-[(1-oxidanylidene-4-thiophen-2-yl-phthalazin-2-yl)methyl]azanium Openeye Name: methyl-[(5-methylisoxazol-3-yl)methyl]-[[1-oxo-4-(2-thienyl)phthalazin-2-yl]methyl]ammonium CAS Name: methyl-[(5-methyl-3-isoxazolyl)methyl]-[(1-oxo-4-thiophen-2-yl-2-phthalazinyl)methyl]ammonium IUPAC Name: methyl-[(5-methyl-1,2-oxazol-3-yl)methyl]-[(1-oxo-4-thiophen-2-ylphthalazin-2-yl)methyl]azanium Traditional Name: [1-keto-4-(2-thienyl)phthalazin-2-yl]methyl-methyl-[(5-methylisoxazol-3-yl)methyl]ammonium Formula: C19H19N4O2S+ MolecularWeight: 367.44476

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)C[NH+](C)CN2C(=O)C3=CC=CC=C3C(=N2)C4=CC=CS4

Isomeric SMILES

CC1=CC(=NO1)C[NH+](C)CN2C(=O)C3=CC=CC=C3C(=N2)C4=CC=CS4

InChI

InChI=1S/C19H18N4O2S/c1-13-10-14(21-25-13)11-22(2)12-23-19(24)16-7-4-3-6-15(16)18(20-23)17-8-5-9-26-17/h3-10H,11-12H2,1-2H3/p+1