(2S)-2-[4,5-dimethyl-1-[[(2R)-oxolan-2-yl]methyl]imidazol-2-yl]sulfanyl-2-phenyl-1-piperidin-1-yl-ethanone

Systemtic Name: (2S)-2-[4,5-dimethyl-1-[[(2R)-oxolan-2-yl]methyl]imidazol-2-yl]sulfanyl-2-phenyl-1-piperidin-1-yl-ethanone Openeye Name: (2S)-2-[4,5-dimethyl-1-[[(2R)-tetrahydrofuran-2-yl]methyl]imidazol-2-yl]sulfanyl-2-phenyl-1-(1-piperidyl)ethanone CAS Name: (2S)-2-[[4,5-dimethyl-1-[[(2R)-2-oxolanyl]methyl]-2-imidazolyl]thio]-2-phenyl-1-(1-piperidinyl)ethanone IUPAC Name: (2S)-2-[4,5-dimethyl-1-[[(2R)-oxolan-2-yl]methyl]imidazol-2-yl]sulfanyl-2-phenyl-1-piperidin-1-ylethanone Traditional Name: (2S)-2-[[4,5-dimethyl-1-[[(2R)-tetrahydrofuran-2-yl]methyl]imidazol-2-yl]thio]-2-phenyl-1-piperidino-ethanone Formula: C23H31N3O2S MolecularWeight: 413.57614

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=N1)SC(C2=CC=CC=C2)C(=O)N3CCCCC3)CC4CCCO4)C

Isomeric SMILES

CC1=C(N(C(=N1)S[C@@H](C2=CC=CC=C2)C(=O)N3CCCCC3)C[C@H]4CCCO4)C

InChI

InChI=1S/C23H31N3O2S/c1-17-18(2)26(16-20-12-9-15-28-20)23(24-17)29-21(19-10-5-3-6-11-19)22(27)25-13-7-4-8-14-25/h3,5-6,10-11,20-21H,4,7-9,12-16H2,1-2H3/t20-,21+/m1/s1