[(2S)-1-[(3-phenethyl-2-propan-2-ylsulfonyl-imidazol-4-yl)methyl]piperidin-2-yl]methanol

Systemtic Name: [(2S)-1-[(3-phenethyl-2-propan-2-ylsulfonyl-imidazol-4-yl)methyl]piperidin-2-yl]methanol Openeye Name: [(2S)-1-[(2-isopropylsulfonyl-3-phenethyl-imidazol-4-yl)methyl]-2-piperidyl]methanol CAS Name: [(2S)-1-[(3-phenethyl-2-propan-2-ylsulfonyl-4-imidazolyl)methyl]-2-piperidinyl]methanol IUPAC Name: [(2S)-1-[(3-phenethyl-2-propan-2-ylsulfonylimidazol-4-yl)methyl]piperidin-2-yl]methanol Traditional Name: [(2S)-1-[(2-isopropylsulfonyl-3-phenethyl-imidazol-4-yl)methyl]-2-piperidyl]methanol Formula: C21H31N3O3S MolecularWeight: 405.55414

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)C1=NC=C(N1CCC2=CC=CC=C2)CN3CCCCC3CO

Isomeric SMILES

CC(C)S(=O)(=O)C1=NC=C(N1CCC2=CC=CC=C2)CN3CCCC[C@H]3CO

InChI

InChI=1S/C21H31N3O3S/c1-17(2)28(26,27)21-22-14-20(15-23-12-7-6-10-19(23)16-25)24(21)13-11-18-8-4-3-5-9-18/h3-5,8-9,14,17,19,25H,6-7,10-13,15-16H2,1-2H3/t19-/m0/s1