5-(hydroxymethyl)-1-methyl-3-(phenylmethyl)-4-pyridin-4-ylsulfanyl-imidazol-2-one

Systemtic Name: 5-(hydroxymethyl)-1-methyl-3-(phenylmethyl)-4-pyridin-4-ylsulfanyl-imidazol-2-one Openeye Name: 1-benzyl-4-(hydroxymethyl)-3-methyl-5-(4-pyridylsulfanyl)imidazol-2-one CAS Name: 5-(hydroxymethyl)-1-methyl-3-(phenylmethyl)-4-(pyridin-4-ylthio)-2-imidazolone IUPAC Name: 1-benzyl-4-(hydroxymethyl)-3-methyl-5-pyridin-4-ylsulfanylimidazol-2-one Traditional Name: 1-benzyl-3-methyl-4-methylol-5-(4-pyridylthio)-4-imidazolin-2-one Formula: C17H17N3O2S MolecularWeight: 327.40078

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(N(C1=O)CC2=CC=CC=C2)SC3=CC=NC=C3)CO

Isomeric SMILES

CN1C(=C(N(C1=O)CC2=CC=CC=C2)SC3=CC=NC=C3)CO

InChI

InChI=1S/C17H17N3O2S/c1-19-15(12-21)16(23-14-7-9-18-10-8-14)20(17(19)22)11-13-5-3-2-4-6-13/h2-10,21H,11-12H2,1H3