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

Systemtic Name: 2-(6-methyl-2-phenacylsulfanyl-pyrimidin-4-yl)sulfanyl-1-phenyl-ethanone Openeye Name: 2-(6-methyl-2-phenacylsulfanyl-pyrimidin-4-yl)sulfanyl-1-phenyl-ethanone CAS Name: 2-[[6-methyl-2-(phenacylthio)-4-pyrimidinyl]thio]-1-phenylethanone IUPAC Name: 2-(6-methyl-2-phenacylsulfanylpyrimidin-4-yl)sulfanyl-1-phenylethanone Traditional Name: 2-[[6-methyl-2-(phenacylthio)pyrimidin-4-yl]thio]-1-phenyl-ethanone Formula: C21H18N2O2S2 MolecularWeight: 394.50982

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H18N2O2S2/c1-15-12-20(26-13-18(24)16-8-4-2-5-9-16)23-21(22-15)27-14-19(25)17-10-6-3-7-11-17/h2-12H,13-14H2,1H3