1-(4,6-diphenylpyrimidin-2-yl)sulfanyl-3,3-dimethyl-butan-2-one

Systemtic Name: 1-(4,6-diphenylpyrimidin-2-yl)sulfanyl-3,3-dimethyl-butan-2-one Openeye Name: 1-(4,6-diphenylpyrimidin-2-yl)sulfanyl-3,3-dimethyl-butan-2-one CAS Name: 1-[(4,6-diphenyl-2-pyrimidinyl)thio]-3,3-dimethyl-2-butanone IUPAC Name: 1-(4,6-diphenylpyrimidin-2-yl)sulfanyl-3,3-dimethylbutan-2-one Traditional Name: 1-[(4,6-diphenylpyrimidin-2-yl)thio]-3,3-dimethyl-butan-2-one Formula: C22H22N2OS MolecularWeight: 362.48788

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)CSC1=NC(=CC(=N1)C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)C(=O)CSC1=NC(=CC(=N1)C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C22H22N2OS/c1-22(2,3)20(25)15-26-21-23-18(16-10-6-4-7-11-16)14-19(24-21)17-12-8-5-9-13-17/h4-14H,15H2,1-3H3