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

Systemtic Name: 2-[1-[[(2S)-oxolan-2-yl]methyl]-5-phenyl-imidazol-2-yl]sulfanyl-1-piperidin-1-yl-ethanone Openeye Name: 2-[5-phenyl-1-[[(2S)-tetrahydrofuran-2-yl]methyl]imidazol-2-yl]sulfanyl-1-(1-piperidyl)ethanone CAS Name: 2-[[1-[[(2S)-2-oxolanyl]methyl]-5-phenyl-2-imidazolyl]thio]-1-(1-piperidinyl)ethanone IUPAC Name: 2-[1-[[(2S)-oxolan-2-yl]methyl]-5-phenylimidazol-2-yl]sulfanyl-1-piperidin-1-ylethanone Traditional Name: 2-[[5-phenyl-1-[[(2S)-tetrahydrofuran-2-yl]methyl]imidazol-2-yl]thio]-1-piperidino-ethanone Formula: C21H27N3O2S MolecularWeight: 385.52298

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)CSC2=NC=C(N2CC3CCCO3)C4=CC=CC=C4

Isomeric SMILES

C1CCN(CC1)C(=O)CSC2=NC=C(N2C[C@@H]3CCCO3)C4=CC=CC=C4

InChI

InChI=1S/C21H27N3O2S/c25-20(23-11-5-2-6-12-23)16-27-21-22-14-19(17-8-3-1-4-9-17)24(21)15-18-10-7-13-26-18/h1,3-4,8-9,14,18H,2,5-7,10-13,15-16H2/t18-/m0/s1