3-methyl-4-oxidanylidene-N-[2-(thiophen-2-ylmethylsulfanyl)ethyl]phthalazine-1-carboxamide

Systemtic Name: 3-methyl-4-oxidanylidene-N-[2-(thiophen-2-ylmethylsulfanyl)ethyl]phthalazine-1-carboxamide Openeye Name: 3-methyl-4-oxo-N-[2-(2-thienylmethylsulfanyl)ethyl]phthalazine-1-carboxamide CAS Name: 3-methyl-4-oxo-N-[2-(thiophen-2-ylmethylthio)ethyl]-1-phthalazinecarboxamide IUPAC Name: 3-methyl-4-oxo-N-[2-(thiophen-2-ylmethylsulfanyl)ethyl]phthalazine-1-carboxamide Traditional Name: 4-keto-3-methyl-N-[2-(2-thenylthio)ethyl]phthalazine-1-carboxamide Formula: C17H17N3O2S2 MolecularWeight: 359.46578

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCCSCC3=CC=CS3

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCCSCC3=CC=CS3

InChI

InChI=1S/C17H17N3O2S2/c1-20-17(22)14-7-3-2-6-13(14)15(19-20)16(21)18-8-10-23-11-12-5-4-9-24-12/h2-7,9H,8,10-11H2,1H3,(H,18,21)