4-oxidanylidene-5-[[(3S)-thiolan-3-yl]amino]-3H-phthalazin-1-olate

Systemtic Name: 4-oxidanylidene-5-[[(3S)-thiolan-3-yl]amino]-3H-phthalazin-1-olate Openeye Name: 4-oxo-5-[[(3S)-tetrahydrothiophen-3-yl]amino]-3H-phthalazin-1-olate CAS Name: 4-oxo-5-[[(3S)-3-thiolanyl]amino]-3H-phthalazin-1-olate IUPAC Name: 4-oxo-5-[[(3S)-thiolan-3-yl]amino]-3H-phthalazin-1-olate Traditional Name: 4-keto-5-[[(3S)-tetrahydrothiophen-3-yl]amino]-3H-phthalazin-1-olate Formula: C12H12N3O2S- MolecularWeight: 262.30758

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Descriptors Computed from Structure

Canonical SMILES:

C1CSCC1NC2=CC=CC3=C2C(=O)NN=C3[O-]

Isomeric SMILES

C1CSC[C@H]1NC2=CC=CC3=C2C(=O)NN=C3[O-]

InChI

InChI=1S/C12H13N3O2S/c16-11-8-2-1-3-9(10(8)12(17)15-14-11)13-7-4-5-18-6-7/h1-3,7,13H,4-6H2,(H,14,16)(H,15,17)/p-1/t7-/m0/s1