[1-(3,4-dimethylphenyl)sulfonylpiperidin-4-yl]-[4-(2-methylpropyl)piperazin-1-yl]methanone

Systemtic Name: [1-(3,4-dimethylphenyl)sulfonylpiperidin-4-yl]-[4-(2-methylpropyl)piperazin-1-yl]methanone Openeye Name: [1-(3,4-dimethylphenyl)sulfonyl-4-piperidyl]-(4-isobutylpiperazin-1-yl)methanone CAS Name: [1-(3,4-dimethylphenyl)sulfonyl-4-piperidinyl]-[4-(2-methylpropyl)-1-piperazinyl]methanone IUPAC Name: [1-(3,4-dimethylphenyl)sulfonylpiperidin-4-yl]-[4-(2-methylpropyl)piperazin-1-yl]methanone Traditional Name: [1-(3,4-dimethylphenyl)sulfonyl-4-piperidyl]-(4-isobutylpiperazino)methanone Formula: C22H35N3O3S MolecularWeight: 421.5966

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)N3CCN(CC3)CC(C)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)N3CCN(CC3)CC(C)C)C

InChI

InChI=1S/C22H35N3O3S/c1-17(2)16-23-11-13-24(14-12-23)22(26)20-7-9-25(10-8-20)29(27,28)21-6-5-18(3)19(4)15-21/h5-6,15,17,20H,7-14,16H2,1-4H3