2-(5-ethanoyl-6-methyl-2-phenyl-pyrimidin-4-yl)sulfanyl-1-phenyl-ethanone

Systemtic Name: 2-(5-ethanoyl-6-methyl-2-phenyl-pyrimidin-4-yl)sulfanyl-1-phenyl-ethanone Openeye Name: 2-(5-acetyl-6-methyl-2-phenyl-pyrimidin-4-yl)sulfanyl-1-phenyl-ethanone CAS Name: 2-[(5-acetyl-6-methyl-2-phenyl-4-pyrimidinyl)thio]-1-phenylethanone IUPAC Name: 2-(5-acetyl-6-methyl-2-phenylpyrimidin-4-yl)sulfanyl-1-phenylethanone Traditional Name: 2-[(5-acetyl-6-methyl-2-phenyl-pyrimidin-4-yl)thio]-1-phenyl-ethanone Formula: C21H18N2O2S MolecularWeight: 362.44482

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)C2=CC=CC=C2)SCC(=O)C3=CC=CC=C3)C(=O)C

Isomeric SMILES

CC1=C(C(=NC(=N1)C2=CC=CC=C2)SCC(=O)C3=CC=CC=C3)C(=O)C

InChI

InChI=1S/C21H18N2O2S/c1-14-19(15(2)24)21(23-20(22-14)17-11-7-4-8-12-17)26-13-18(25)16-9-5-3-6-10-16/h3-12H,13H2,1-2H3