4-azanyl-2-[[4-(2,5-dimethoxyphenyl)sulfonylpiperazin-1-yl]methyl]isoindole-1,3-dione

Systemtic Name: 4-azanyl-2-[[4-(2,5-dimethoxyphenyl)sulfonylpiperazin-1-yl]methyl]isoindole-1,3-dione Openeye Name: 4-amino-2-[[4-(2,5-dimethoxyphenyl)sulfonylpiperazin-1-yl]methyl]isoindoline-1,3-dione CAS Name: 4-amino-2-[[4-(2,5-dimethoxyphenyl)sulfonyl-1-piperazinyl]methyl]isoindole-1,3-dione IUPAC Name: 4-amino-2-[[4-(2,5-dimethoxyphenyl)sulfonylpiperazin-1-yl]methyl]isoindole-1,3-dione Traditional Name: 4-amino-2-[[4-(2,5-dimethoxyphenyl)sulfonylpiperazino]methyl]isoindoline-1,3-quinone Formula: C21H24N4O6S MolecularWeight: 460.50346

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)S(=O)(=O)N2CCN(CC2)CN3C(=O)C4=C(C3=O)C(=CC=C4)N

Isomeric SMILES

COC1=CC(=C(C=C1)OC)S(=O)(=O)N2CCN(CC2)CN3C(=O)C4=C(C3=O)C(=CC=C4)N

InChI

InChI=1S/C21H24N4O6S/c1-30-14-6-7-17(31-2)18(12-14)32(28,29)24-10-8-23(9-11-24)13-25-20(26)15-4-3-5-16(22)19(15)21(25)27/h3-7,12H,8-11,13,22H2,1-2H3