2-[4-(hydroxymethyl)-1-(phenylmethyl)imidazol-2-yl]sulfanyl-1-piperidin-1-yl-ethanone

Systemtic Name: 2-[4-(hydroxymethyl)-1-(phenylmethyl)imidazol-2-yl]sulfanyl-1-piperidin-1-yl-ethanone Openeye Name: 2-[1-benzyl-4-(hydroxymethyl)imidazol-2-yl]sulfanyl-1-(1-piperidyl)ethanone CAS Name: 2-[[4-(hydroxymethyl)-1-(phenylmethyl)-2-imidazolyl]thio]-1-(1-piperidinyl)ethanone IUPAC Name: 2-[1-benzyl-4-(hydroxymethyl)imidazol-2-yl]sulfanyl-1-piperidin-1-ylethanone Traditional Name: 2-[(1-benzyl-4-methylol-imidazol-2-yl)thio]-1-piperidino-ethanone Formula: C18H23N3O2S MolecularWeight: 345.45912

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)CSC2=NC(=CN2CC3=CC=CC=C3)CO

Isomeric SMILES

C1CCN(CC1)C(=O)CSC2=NC(=CN2CC3=CC=CC=C3)CO

InChI

InChI=1S/C18H23N3O2S/c22-13-16-12-21(11-15-7-3-1-4-8-15)18(19-16)24-14-17(23)20-9-5-2-6-10-20/h1,3-4,7-8,12,22H,2,5-6,9-11,13-14H2