1-(3,4-dimethylphenyl)-2-(4,5,6-trimethylpyrimidin-2-yl)sulfanyl-propan-1-one

Systemtic Name: 1-(3,4-dimethylphenyl)-2-(4,5,6-trimethylpyrimidin-2-yl)sulfanyl-propan-1-one Openeye Name: 1-(3,4-dimethylphenyl)-2-(4,5,6-trimethylpyrimidin-2-yl)sulfanyl-propan-1-one CAS Name: 1-(3,4-dimethylphenyl)-2-[(4,5,6-trimethyl-2-pyrimidinyl)thio]-1-propanone IUPAC Name: 1-(3,4-dimethylphenyl)-2-(4,5,6-trimethylpyrimidin-2-yl)sulfanylpropan-1-one Traditional Name: 1-(3,4-dimethylphenyl)-2-[(4,5,6-trimethylpyrimidin-2-yl)thio]propan-1-one Formula: C18H22N2OS MolecularWeight: 314.44508

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)C(C)SC2=NC(=C(C(=N2)C)C)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)C(C)SC2=NC(=C(C(=N2)C)C)C)C

InChI

InChI=1S/C18H22N2OS/c1-10-7-8-16(9-11(10)2)17(21)15(6)22-18-19-13(4)12(3)14(5)20-18/h7-9,15H,1-6H3