3-[2-(4-methyl-2-oxidanylidene-1,3-thiazol-3-yl)ethyl]-4-oxidanylidene-phthalazine-1-carboxylate

Systemtic Name: 3-[2-(4-methyl-2-oxidanylidene-1,3-thiazol-3-yl)ethyl]-4-oxidanylidene-phthalazine-1-carboxylate Openeye Name: 3-[2-(4-methyl-2-oxo-thiazol-3-yl)ethyl]-4-oxo-phthalazine-1-carboxylate CAS Name: 3-[2-(4-methyl-2-oxo-3-thiazolyl)ethyl]-4-oxo-1-phthalazinecarboxylate IUPAC Name: 3-[2-(4-methyl-2-oxo-1,3-thiazol-3-yl)ethyl]-4-oxophthalazine-1-carboxylate Traditional Name: 4-keto-3-[2-(2-keto-4-methyl-4-thiazolin-3-yl)ethyl]phthalazine-1-carboxylate Formula: C15H12N3O4S- MolecularWeight: 330.33848

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=O)N1CCN2C(=O)C3=CC=CC=C3C(=N2)C(=O)[O-]

Isomeric SMILES

CC1=CSC(=O)N1CCN2C(=O)C3=CC=CC=C3C(=N2)C(=O)[O-]

InChI

InChI=1S/C15H13N3O4S/c1-9-8-23-15(22)17(9)6-7-18-13(19)11-5-3-2-4-10(11)12(16-18)14(20)21/h2-5,8H,6-7H2,1H3,(H,20,21)/p-1