3-[1-(1,3-benzothiazol-2-yl)-6-oxidanylidene-4,5-dihydropyridazin-3-yl]propanoate

Systemtic Name: 3-[1-(1,3-benzothiazol-2-yl)-6-oxidanylidene-4,5-dihydropyridazin-3-yl]propanoate Openeye Name: 3-[1-(1,3-benzothiazol-2-yl)-6-oxo-4,5-dihydropyridazin-3-yl]propanoate CAS Name: 3-[1-(1,3-benzothiazol-2-yl)-6-oxo-4,5-dihydropyridazin-3-yl]propanoate IUPAC Name: 3-[1-(1,3-benzothiazol-2-yl)-6-oxo-4,5-dihydropyridazin-3-yl]propanoate Traditional Name: 3-[1-(1,3-benzothiazol-2-yl)-6-keto-4,5-dihydropyridazin-3-yl]propionate Formula: C14H12N3O3S- MolecularWeight: 302.32838

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(N=C1CCC(=O)[O-])C2=NC3=CC=CC=C3S2

Isomeric SMILES

C1CC(=O)N(N=C1CCC(=O)[O-])C2=NC3=CC=CC=C3S2

InChI

InChI=1S/C14H13N3O3S/c18-12-7-5-9(6-8-13(19)20)16-17(12)14-15-10-3-1-2-4-11(10)21-14/h1-4H,5-8H2,(H,19,20)/p-1