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

Systemtic Name: N-[2-(furan-2-ylmethylsulfanyl)ethyl]-3-methyl-4-oxidanylidene-phthalazine-1-carboxamide Openeye Name: N-[2-(2-furylmethylsulfanyl)ethyl]-3-methyl-4-oxo-phthalazine-1-carboxamide CAS Name: N-[2-(2-furanylmethylthio)ethyl]-3-methyl-4-oxo-1-phthalazinecarboxamide IUPAC Name: N-[2-(furan-2-ylmethylsulfanyl)ethyl]-3-methyl-4-oxophthalazine-1-carboxamide Traditional Name: N-[2-(2-furfurylthio)ethyl]-4-keto-3-methyl-phthalazine-1-carboxamide Formula: C17H17N3O3S MolecularWeight: 343.40018

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCCSCC3=CC=CO3

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCCSCC3=CC=CO3

InChI

InChI=1S/C17H17N3O3S/c1-20-17(22)14-7-3-2-6-13(14)15(19-20)16(21)18-8-10-24-11-12-5-4-9-23-12/h2-7,9H,8,10-11H2,1H3,(H,18,21)