8-[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-yl]sulfonylquinoline

Systemtic Name: 8-[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-yl]sulfonylquinoline Openeye Name: 8-[4-(4-isopropylphenyl)sulfonylpiperazin-1-yl]sulfonylquinoline CAS Name: 8-[[4-(4-propan-2-ylphenyl)sulfonyl-1-piperazinyl]sulfonyl]quinoline IUPAC Name: 8-[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-yl]sulfonylquinoline Traditional Name: 8-(4-p-cumenylsulfonylpiperazino)sulfonylquinoline Formula: C22H25N3O4S2 MolecularWeight: 459.5816

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC4=C3N=CC=C4

Isomeric SMILES

CC(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC4=C3N=CC=C4

InChI

InChI=1S/C22H25N3O4S2/c1-17(2)18-8-10-20(11-9-18)30(26,27)24-13-15-25(16-14-24)31(28,29)21-7-3-5-19-6-4-12-23-22(19)21/h3-12,17H,13-16H2,1-2H3