[4-[[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]methyl]phenyl]-pyrrolidin-1-yl-methanone

Systemtic Name: [4-[[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]methyl]phenyl]-pyrrolidin-1-yl-methanone Openeye Name: [4-[[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]methyl]phenyl]-pyrrolidin-1-yl-methanone CAS Name: [4-[[4-(2,5-dimethylphenyl)sulfonyl-1-piperazinyl]methyl]phenyl]-(1-pyrrolidinyl)methanone IUPAC Name: [4-[[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]methyl]phenyl]-pyrrolidin-1-ylmethanone Traditional Name: [4-[[4-(2,5-dimethylphenyl)sulfonylpiperazino]methyl]phenyl]-pyrrolidino-methanone Formula: C24H31N3O3S MolecularWeight: 441.58624

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)N2CCN(CC2)CC3=CC=C(C=C3)C(=O)N4CCCC4

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)N2CCN(CC2)CC3=CC=C(C=C3)C(=O)N4CCCC4

InChI

InChI=1S/C24H31N3O3S/c1-19-5-6-20(2)23(17-19)31(29,30)27-15-13-25(14-16-27)18-21-7-9-22(10-8-21)24(28)26-11-3-4-12-26/h5-10,17H,3-4,11-16,18H2,1-2H3