2-[[1-(furan-2-ylmethyl)-5-(hydroxymethyl)imidazol-2-yl]sulfanylmethyl]benzenecarbonitrile

Systemtic Name: 2-[[1-(furan-2-ylmethyl)-5-(hydroxymethyl)imidazol-2-yl]sulfanylmethyl]benzenecarbonitrile Openeye Name: 2-[[1-(2-furylmethyl)-5-(hydroxymethyl)imidazol-2-yl]sulfanylmethyl]benzonitrile CAS Name: 2-[[[1-(2-furanylmethyl)-5-(hydroxymethyl)-2-imidazolyl]thio]methyl]benzonitrile IUPAC Name: 2-[[1-(furan-2-ylmethyl)-5-(hydroxymethyl)imidazol-2-yl]sulfanylmethyl]benzonitrile Traditional Name: 2-[[[1-(2-furfuryl)-5-methylol-imidazol-2-yl]thio]methyl]benzonitrile Formula: C17H15N3O2S MolecularWeight: 325.3849

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CSC2=NC=C(N2CC3=CC=CO3)CO)C#N

Isomeric SMILES

C1=CC=C(C(=C1)CSC2=NC=C(N2CC3=CC=CO3)CO)C#N

InChI

InChI=1S/C17H15N3O2S/c18-8-13-4-1-2-5-14(13)12-23-17-19-9-15(11-21)20(17)10-16-6-3-7-22-16/h1-7,9,21H,10-12H2