dimethyl-[(1R)-2-[(4-oxidanylidene-3-phenyl-phthalazin-1-yl)carbonylamino]-1-thiophen-2-yl-ethyl]azanium

Systemtic Name: dimethyl-[(1R)-2-[(4-oxidanylidene-3-phenyl-phthalazin-1-yl)carbonylamino]-1-thiophen-2-yl-ethyl]azanium Openeye Name: dimethyl-[(1R)-2-[(4-oxo-3-phenyl-phthalazine-1-carbonyl)amino]-1-(2-thienyl)ethyl]ammonium CAS Name: dimethyl-[(1R)-2-[[oxo-(4-oxo-3-phenyl-1-phthalazinyl)methyl]amino]-1-thiophen-2-ylethyl]ammonium IUPAC Name: dimethyl-[(1R)-2-[(4-oxo-3-phenylphthalazine-1-carbonyl)amino]-1-thiophen-2-ylethyl]azanium Traditional Name: [(1R)-2-[(4-keto-3-phenyl-phthalazine-1-carbonyl)amino]-1-(2-thienyl)ethyl]-dimethyl-ammonium Formula: C23H23N4O2S+ MolecularWeight: 419.51932

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)C(CNC(=O)C1=NN(C(=O)C2=CC=CC=C21)C3=CC=CC=C3)C4=CC=CS4

Isomeric SMILES

C[NH+](C)[C@H](CNC(=O)C1=NN(C(=O)C2=CC=CC=C21)C3=CC=CC=C3)C4=CC=CS4

InChI

InChI=1S/C23H22N4O2S/c1-26(2)19(20-13-8-14-30-20)15-24-22(28)21-17-11-6-7-12-18(17)23(29)27(25-21)16-9-4-3-5-10-16/h3-14,19H,15H2,1-2H3,(H,24,28)/p+1/t19-/m1/s1