2-(4-oxidanylidene-3H-phthalazin-1-yl)-N-[2-(thiophen-3-ylmethylsulfanyl)ethyl]ethanamide

Systemtic Name: 2-(4-oxidanylidene-3H-phthalazin-1-yl)-N-[2-(thiophen-3-ylmethylsulfanyl)ethyl]ethanamide Openeye Name: 2-(4-oxo-3H-phthalazin-1-yl)-N-[2-(3-thienylmethylsulfanyl)ethyl]acetamide CAS Name: 2-(4-oxo-3H-phthalazin-1-yl)-N-[2-(3-thiophenylmethylthio)ethyl]acetamide IUPAC Name: 2-(4-oxo-3H-phthalazin-1-yl)-N-[2-(thiophen-3-ylmethylsulfanyl)ethyl]acetamide Traditional Name: 2-(4-keto-3H-phthalazin-1-yl)-N-[2-(3-thenylthio)ethyl]acetamide Formula: C17H17N3O2S2 MolecularWeight: 359.46578

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NNC2=O)CC(=O)NCCSCC3=CSC=C3

Isomeric SMILES

C1=CC=C2C(=C1)C(=NNC2=O)CC(=O)NCCSCC3=CSC=C3

InChI

InChI=1S/C17H17N3O2S2/c21-16(18-6-8-24-11-12-5-7-23-10-12)9-15-13-3-1-2-4-14(13)17(22)20-19-15/h1-5,7,10H,6,8-9,11H2,(H,18,21)(H,20,22)