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

Systemtic Name: 2-[4-(hydroxymethyl)-1-(phenylmethyl)imidazol-2-yl]sulfanyl-1-pyrrolidin-1-yl-ethanone Openeye Name: 2-[1-benzyl-4-(hydroxymethyl)imidazol-2-yl]sulfanyl-1-pyrrolidin-1-yl-ethanone CAS Name: 2-[[4-(hydroxymethyl)-1-(phenylmethyl)-2-imidazolyl]thio]-1-(1-pyrrolidinyl)ethanone IUPAC Name: 2-[1-benzyl-4-(hydroxymethyl)imidazol-2-yl]sulfanyl-1-pyrrolidin-1-ylethanone Traditional Name: 2-[(1-benzyl-4-methylol-imidazol-2-yl)thio]-1-pyrrolidino-ethanone Formula: C17H21N3O2S MolecularWeight: 331.43254

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)CSC2=NC(=CN2CC3=CC=CC=C3)CO

Isomeric SMILES

C1CCN(C1)C(=O)CSC2=NC(=CN2CC3=CC=CC=C3)CO

InChI

InChI=1S/C17H21N3O2S/c21-12-15-11-20(10-14-6-2-1-3-7-14)17(18-15)23-13-16(22)19-8-4-5-9-19/h1-3,6-7,11,21H,4-5,8-10,12-13H2