2-[4-(2,5-dimethylphenyl)piperazin-1-yl]-6-pyrrolidin-1-ylsulfonyl-quinoline

Systemtic Name: 2-[4-(2,5-dimethylphenyl)piperazin-1-yl]-6-pyrrolidin-1-ylsulfonyl-quinoline Openeye Name: 2-[4-(2,5-dimethylphenyl)piperazin-1-yl]-6-pyrrolidin-1-ylsulfonyl-quinoline CAS Name: 2-[4-(2,5-dimethylphenyl)-1-piperazinyl]-6-(1-pyrrolidinylsulfonyl)quinoline IUPAC Name: 2-[4-(2,5-dimethylphenyl)piperazin-1-yl]-6-pyrrolidin-1-ylsulfonylquinoline Traditional Name: 2-[4-(2,5-dimethylphenyl)piperazino]-6-pyrrolidinosulfonyl-quinoline Formula: C25H30N4O2S MolecularWeight: 450.5963

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2CCN(CC2)C3=NC4=C(C=C3)C=C(C=C4)S(=O)(=O)N5CCCC5

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2CCN(CC2)C3=NC4=C(C=C3)C=C(C=C4)S(=O)(=O)N5CCCC5

InChI

InChI=1S/C25H30N4O2S/c1-19-5-6-20(2)24(17-19)27-13-15-28(16-14-27)25-10-7-21-18-22(8-9-23(21)26-25)32(30,31)29-11-3-4-12-29/h5-10,17-18H,3-4,11-16H2,1-2H3