5-ethyl-2-[4-[4-(4-methylsulfonylphenyl)butyl]piperidin-1-yl]pyrimidine

Systemtic Name: 5-ethyl-2-[4-[4-(4-methylsulfonylphenyl)butyl]piperidin-1-yl]pyrimidine Openeye Name: 5-ethyl-2-[4-[4-(4-methylsulfonylphenyl)butyl]-1-piperidyl]pyrimidine CAS Name: 5-ethyl-2-[4-[4-(4-methylsulfonylphenyl)butyl]-1-piperidinyl]pyrimidine IUPAC Name: 5-ethyl-2-[4-[4-(4-methylsulfonylphenyl)butyl]piperidin-1-yl]pyrimidine Traditional Name: 5-ethyl-2-[4-[4-(4-mesylphenyl)butyl]piperidino]pyrimidine Formula: C22H31N3O2S MolecularWeight: 401.56544

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CN=C(N=C1)N2CCC(CC2)CCCCC3=CC=C(C=C3)S(=O)(=O)C

Isomeric SMILES

CCC1=CN=C(N=C1)N2CCC(CC2)CCCCC3=CC=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C22H31N3O2S/c1-3-18-16-23-22(24-17-18)25-14-12-20(13-15-25)7-5-4-6-19-8-10-21(11-9-19)28(2,26)27/h8-11,16-17,20H,3-7,12-15H2,1-2H3