3-methyl-N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)-4-oxidanylidene-phthalazine-1-carboxamide

Systemtic Name: 3-methyl-N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: 3-methyl-N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)-4-oxo-phthalazine-1-carboxamide CAS Name: 3-methyl-N-[2-(methylthio)-1,3-benzothiazol-6-yl]-4-oxo-1-phthalazinecarboxamide IUPAC Name: 3-methyl-N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)-4-oxophthalazine-1-carboxamide Traditional Name: 4-keto-3-methyl-N-[2-(methylthio)-1,3-benzothiazol-6-yl]phthalazine-1-carboxamide Formula: C18H14N4O2S2 MolecularWeight: 382.45936

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC4=C(C=C3)N=C(S4)SC

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC4=C(C=C3)N=C(S4)SC

InChI

InChI=1S/C18H14N4O2S2/c1-22-17(24)12-6-4-3-5-11(12)15(21-22)16(23)19-10-7-8-13-14(9-10)26-18(20-13)25-2/h3-9H,1-2H3,(H,19,23)