1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-4-(2-thiophen-2-ylpyrrolidin-1-yl)butane-1,4-dione

Systemtic Name: 1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-4-(2-thiophen-2-ylpyrrolidin-1-yl)butane-1,4-dione Openeye Name: 1-[4-(p-tolylsulfonyl)piperazin-1-yl]-4-[2-(2-thienyl)pyrrolidin-1-yl]butane-1,4-dione CAS Name: 1-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]-4-(2-thiophen-2-yl-1-pyrrolidinyl)butane-1,4-dione IUPAC Name: 1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-4-(2-thiophen-2-ylpyrrolidin-1-yl)butane-1,4-dione Traditional Name: 1-[2-(2-thienyl)pyrrolidino]-4-(4-tosylpiperazino)butane-1,4-dione Formula: C23H29N3O4S2 MolecularWeight: 475.62406

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CCC(=O)N3CCCC3C4=CC=CS4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CCC(=O)N3CCCC3C4=CC=CS4

InChI

InChI=1S/C23H29N3O4S2/c1-18-6-8-19(9-7-18)32(29,30)25-15-13-24(14-16-25)22(27)10-11-23(28)26-12-2-4-20(26)21-5-3-17-31-21/h3,5-9,17,20H,2,4,10-16H2,1H3