2-(1-methylimidazol-2-yl)sulfanyl-1-phenyl-propan-1-one

Systemtic Name: 2-(1-methylimidazol-2-yl)sulfanyl-1-phenyl-propan-1-one Openeye Name: 2-(1-methylimidazol-2-yl)sulfanyl-1-phenyl-propan-1-one CAS Name: 2-[(1-methyl-2-imidazolyl)thio]-1-phenyl-1-propanone IUPAC Name: 2-(1-methylimidazol-2-yl)sulfanyl-1-phenylpropan-1-one Traditional Name: 2-[(1-methylimidazol-2-yl)thio]-1-phenyl-propan-1-one Formula: C13H14N2OS MolecularWeight: 246.32806

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CC=CC=C1)SC2=NC=CN2C

Isomeric SMILES

CC(C(=O)C1=CC=CC=C1)SC2=NC=CN2C

InChI

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