4-[4-(3-chlorophenyl)sulfonylpiperazin-1-yl]carbonyl-2H-phthalazin-1-one

Systemtic Name: 4-[4-(3-chlorophenyl)sulfonylpiperazin-1-yl]carbonyl-2H-phthalazin-1-one Openeye Name: 4-[4-(3-chlorophenyl)sulfonylpiperazine-1-carbonyl]-2H-phthalazin-1-one CAS Name: 4-[[4-(3-chlorophenyl)sulfonyl-1-piperazinyl]-oxomethyl]-2H-phthalazin-1-one IUPAC Name: 4-[4-(3-chlorophenyl)sulfonylpiperazine-1-carbonyl]-2H-phthalazin-1-one Traditional Name: 4-[4-(3-chlorophenyl)sulfonylpiperazine-1-carbonyl]-2H-phthalazin-1-one Formula: C19H17ClN4O4S MolecularWeight: 432.88068

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H17ClN4O4S/c20-13-4-3-5-14(12-13)29(27,28)24-10-8-23(9-11-24)19(26)17-15-6-1-2-7-16(15)18(25)22-21-17/h1-7,12H,8-11H2,(H,22,25)