2-[[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]methyl]-4-thiophen-2-yl-phthalazin-1-one

Systemtic Name: 2-[[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]methyl]-4-thiophen-2-yl-phthalazin-1-one Openeye Name: 2-[[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]methyl]-4-(2-thienyl)phthalazin-1-one CAS Name: 2-[[4-(4-methoxyphenyl)sulfonyl-1-piperazinyl]methyl]-4-thiophen-2-yl-1-phthalazinone IUPAC Name: 2-[[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]methyl]-4-thiophen-2-ylphthalazin-1-one Traditional Name: 2-[[4-(4-methoxyphenyl)sulfonylpiperazino]methyl]-4-(2-thienyl)phthalazin-1-one Formula: C24H24N4O4S2 MolecularWeight: 496.60176

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CN3C(=O)C4=CC=CC=C4C(=N3)C5=CC=CS5

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CN3C(=O)C4=CC=CC=C4C(=N3)C5=CC=CS5

InChI

InChI=1S/C24H24N4O4S2/c1-32-18-8-10-19(11-9-18)34(30,31)27-14-12-26(13-15-27)17-28-24(29)21-6-3-2-5-20(21)23(25-28)22-7-4-16-33-22/h2-11,16H,12-15,17H2,1H3