4-(4-thiophen-2-ylsulfonylpiperazin-1-yl)carbonyl-2H-phthalazin-1-one

Systemtic Name: 4-(4-thiophen-2-ylsulfonylpiperazin-1-yl)carbonyl-2H-phthalazin-1-one Openeye Name: 4-[4-(2-thienylsulfonyl)piperazine-1-carbonyl]-2H-phthalazin-1-one CAS Name: 4-[oxo-(4-thiophen-2-ylsulfonyl-1-piperazinyl)methyl]-2H-phthalazin-1-one IUPAC Name: 4-(4-thiophen-2-ylsulfonylpiperazine-1-carbonyl)-2H-phthalazin-1-one Traditional Name: 4-[4-(2-thienylsulfonyl)piperazine-1-carbonyl]-2H-phthalazin-1-one Formula: C17H16N4O4S2 MolecularWeight: 404.46334

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=NNC(=O)C3=CC=CC=C32)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

C1CN(CCN1C(=O)C2=NNC(=O)C3=CC=CC=C32)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C17H16N4O4S2/c22-16-13-5-2-1-4-12(13)15(18-19-16)17(23)20-7-9-21(10-8-20)27(24,25)14-6-3-11-26-14/h1-6,11H,7-10H2,(H,19,22)