2-(1-methylimidazol-2-yl)sulfanyl-1-(2,4,5-trimethylphenyl)propan-1-one

Systemtic Name: 2-(1-methylimidazol-2-yl)sulfanyl-1-(2,4,5-trimethylphenyl)propan-1-one Openeye Name: 2-(1-methylimidazol-2-yl)sulfanyl-1-(2,4,5-trimethylphenyl)propan-1-one CAS Name: 2-[(1-methyl-2-imidazolyl)thio]-1-(2,4,5-trimethylphenyl)-1-propanone IUPAC Name: 2-(1-methylimidazol-2-yl)sulfanyl-1-(2,4,5-trimethylphenyl)propan-1-one Traditional Name: 2-[(1-methylimidazol-2-yl)thio]-1-(2,4,5-trimethylphenyl)propan-1-one Formula: C16H20N2OS MolecularWeight: 288.4078

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(=O)C(C)SC2=NC=CN2C)C)C

Isomeric SMILES

CC1=CC(=C(C=C1C(=O)C(C)SC2=NC=CN2C)C)C

InChI

InChI=1S/C16H20N2OS/c1-10-8-12(3)14(9-11(10)2)15(19)13(4)20-16-17-6-7-18(16)5/h6-9,13H,1-5H3