4-oxidanylidene-5-[[(1S)-1-thiophen-2-ylethyl]amino]-3H-phthalazin-1-olate

Systemtic Name: 4-oxidanylidene-5-[[(1S)-1-thiophen-2-ylethyl]amino]-3H-phthalazin-1-olate Openeye Name: 4-oxo-5-[[(1S)-1-(2-thienyl)ethyl]amino]-3H-phthalazin-1-olate CAS Name: 4-oxo-5-[[(1S)-1-thiophen-2-ylethyl]amino]-3H-phthalazin-1-olate IUPAC Name: 4-oxo-5-[[(1S)-1-thiophen-2-ylethyl]amino]-3H-phthalazin-1-olate Traditional Name: 4-keto-5-[[(1S)-1-(2-thienyl)ethyl]amino]-3H-phthalazin-1-olate Formula: C14H12N3O2S- MolecularWeight: 286.32898

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CS1)NC2=CC=CC3=C2C(=O)NN=C3[O-]

Isomeric SMILES

C[C@@H](C1=CC=CS1)NC2=CC=CC3=C2C(=O)NN=C3[O-]

InChI

InChI=1S/C14H13N3O2S/c1-8(11-6-3-7-20-11)15-10-5-2-4-9-12(10)14(19)17-16-13(9)18/h2-8,15H,1H3,(H,16,18)(H,17,19)/p-1/t8-/m0/s1