(2S)-1-[[3-(3-methylbutyl)-2-propan-2-ylsulfonyl-imidazol-4-yl]methyl]-2-(2-pyrazol-1-ylethyl)piperidine

Systemtic Name: (2S)-1-[[3-(3-methylbutyl)-2-propan-2-ylsulfonyl-imidazol-4-yl]methyl]-2-(2-pyrazol-1-ylethyl)piperidine Openeye Name: (2S)-1-[(3-isopentyl-2-isopropylsulfonyl-imidazol-4-yl)methyl]-2-(2-pyrazol-1-ylethyl)piperidine CAS Name: (2S)-1-[[3-(3-methylbutyl)-2-propan-2-ylsulfonyl-4-imidazolyl]methyl]-2-[2-(1-pyrazolyl)ethyl]piperidine IUPAC Name: (2S)-1-[[3-(3-methylbutyl)-2-propan-2-ylsulfonylimidazol-4-yl]methyl]-2-(2-pyrazol-1-ylethyl)piperidine Traditional Name: (2S)-1-[(3-isoamyl-2-isopropylsulfonyl-imidazol-4-yl)methyl]-2-(2-pyrazol-1-ylethyl)piperidine Formula: C22H37N5O2S MolecularWeight: 435.62648

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C(=CN=C1S(=O)(=O)C(C)C)CN2CCCCC2CCN3C=CC=N3

Isomeric SMILES

CC(C)CCN1C(=CN=C1S(=O)(=O)C(C)C)CN2CCCC[C@H]2CCN3C=CC=N3

InChI

InChI=1S/C22H37N5O2S/c1-18(2)9-15-27-21(16-23-22(27)30(28,29)19(3)4)17-25-12-6-5-8-20(25)10-14-26-13-7-11-24-26/h7,11,13,16,18-20H,5-6,8-10,12,14-15,17H2,1-4H3/t20-/m0/s1