1-(1-methyl-5-phenyl-imidazol-2-yl)sulfanylpropan-2-one

Systemtic Name: 1-(1-methyl-5-phenyl-imidazol-2-yl)sulfanylpropan-2-one Openeye Name: 1-(1-methyl-5-phenyl-imidazol-2-yl)sulfanylpropan-2-one CAS Name: 1-[(1-methyl-5-phenyl-2-imidazolyl)thio]-2-propanone IUPAC Name: 1-(1-methyl-5-phenylimidazol-2-yl)sulfanylpropan-2-one Traditional Name: 1-[(1-methyl-5-phenyl-imidazol-2-yl)thio]acetone Formula: C13H14N2OS MolecularWeight: 246.32806

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CSC1=NC=C(N1C)C2=CC=CC=C2

Isomeric SMILES

CC(=O)CSC1=NC=C(N1C)C2=CC=CC=C2

InChI

InChI=1S/C13H14N2OS/c1-10(16)9-17-13-14-8-12(15(13)2)11-6-4-3-5-7-11/h3-8H,9H2,1-2H3