4,6-dimethyl-2-[4-[4-[2-(phenylsulfonyl)ethyl]piperazin-1-yl]piperidin-1-yl]pyrimidine

Systemtic Name: 4,6-dimethyl-2-[4-[4-[2-(phenylsulfonyl)ethyl]piperazin-1-yl]piperidin-1-yl]pyrimidine Openeye Name: 2-[4-[4-[2-(benzenesulfonyl)ethyl]piperazin-1-yl]-1-piperidyl]-4,6-dimethyl-pyrimidine CAS Name: 2-[4-[4-[2-(benzenesulfonyl)ethyl]-1-piperazinyl]-1-piperidinyl]-4,6-dimethylpyrimidine IUPAC Name: 2-[4-[4-[2-(benzenesulfonyl)ethyl]piperazin-1-yl]piperidin-1-yl]-4,6-dimethylpyrimidine Traditional Name: 2-[4-[4-(2-besylethyl)piperazino]piperidino]-4,6-dimethyl-pyrimidine Formula: C23H33N5O2S MolecularWeight: 443.60542

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N2CCC(CC2)N3CCN(CC3)CCS(=O)(=O)C4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=NC(=N1)N2CCC(CC2)N3CCN(CC3)CCS(=O)(=O)C4=CC=CC=C4)C

InChI

InChI=1S/C23H33N5O2S/c1-19-18-20(2)25-23(24-19)28-10-8-21(9-11-28)27-14-12-26(13-15-27)16-17-31(29,30)22-6-4-3-5-7-22/h3-7,18,21H,8-17H2,1-2H3