1-[1-(4-butoxyphenyl)sulfonyl-3,5-dimethyl-pyrazol-4-yl]sulfonyl-4-methyl-piperidine

Systemtic Name: 1-[1-(4-butoxyphenyl)sulfonyl-3,5-dimethyl-pyrazol-4-yl]sulfonyl-4-methyl-piperidine Openeye Name: 1-[1-(4-butoxyphenyl)sulfonyl-3,5-dimethyl-pyrazol-4-yl]sulfonyl-4-methyl-piperidine CAS Name: 1-[[1-(4-butoxyphenyl)sulfonyl-3,5-dimethyl-4-pyrazolyl]sulfonyl]-4-methylpiperidine IUPAC Name: 1-[1-(4-butoxyphenyl)sulfonyl-3,5-dimethylpyrazol-4-yl]sulfonyl-4-methylpiperidine Traditional Name: 1-[1-(4-butoxyphenyl)sulfonyl-3,5-dimethyl-pyrazol-4-yl]sulfonyl-4-methyl-piperidine Formula: C21H31N3O5S2 MolecularWeight: 469.61794

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)S(=O)(=O)N2C(=C(C(=N2)C)S(=O)(=O)N3CCC(CC3)C)C

Isomeric SMILES

CCCCOC1=CC=C(C=C1)S(=O)(=O)N2C(=C(C(=N2)C)S(=O)(=O)N3CCC(CC3)C)C

InChI

InChI=1S/C21H31N3O5S2/c1-5-6-15-29-19-7-9-20(10-8-19)30(25,26)24-18(4)21(17(3)22-24)31(27,28)23-13-11-16(2)12-14-23/h7-10,16H,5-6,11-15H2,1-4H3