2-[4-methyl-6-(2-oxidanylidene-2-piperidin-1-yl-ethyl)sulfanyl-pyrimidin-2-yl]sulfanyl-1-phenyl-ethanone

Systemtic Name: 2-[4-methyl-6-(2-oxidanylidene-2-piperidin-1-yl-ethyl)sulfanyl-pyrimidin-2-yl]sulfanyl-1-phenyl-ethanone Openeye Name: 2-[4-methyl-6-[2-oxo-2-(1-piperidyl)ethyl]sulfanyl-pyrimidin-2-yl]sulfanyl-1-phenyl-ethanone CAS Name: 2-[[4-methyl-6-[[2-oxo-2-(1-piperidinyl)ethyl]thio]-2-pyrimidinyl]thio]-1-phenylethanone IUPAC Name: 2-[4-methyl-6-(2-oxo-2-piperidin-1-ylethyl)sulfanylpyrimidin-2-yl]sulfanyl-1-phenylethanone Traditional Name: 2-[[4-[(2-keto-2-piperidino-ethyl)thio]-6-methyl-pyrimidin-2-yl]thio]-1-phenyl-ethanone Formula: C20H23N3O2S2 MolecularWeight: 401.54552

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC(=O)C2=CC=CC=C2)SCC(=O)N3CCCCC3

Isomeric SMILES

CC1=CC(=NC(=N1)SCC(=O)C2=CC=CC=C2)SCC(=O)N3CCCCC3

InChI

InChI=1S/C20H23N3O2S2/c1-15-12-18(26-14-19(25)23-10-6-3-7-11-23)22-20(21-15)27-13-17(24)16-8-4-2-5-9-16/h2,4-5,8-9,12H,3,6-7,10-11,13-14H2,1H3