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

Systemtic Name: 2-(5-ethanoyl-6-methyl-2-phenyl-pyrimidin-4-yl)sulfanyl-1-piperidin-1-yl-ethanone Openeye Name: 2-(5-acetyl-6-methyl-2-phenyl-pyrimidin-4-yl)sulfanyl-1-(1-piperidyl)ethanone CAS Name: 2-[(5-acetyl-6-methyl-2-phenyl-4-pyrimidinyl)thio]-1-(1-piperidinyl)ethanone IUPAC Name: 2-(5-acetyl-6-methyl-2-phenylpyrimidin-4-yl)sulfanyl-1-piperidin-1-ylethanone Traditional Name: 2-[(5-acetyl-6-methyl-2-phenyl-pyrimidin-4-yl)thio]-1-piperidino-ethanone Formula: C20H23N3O2S MolecularWeight: 369.48052

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23N3O2S/c1-14-18(15(2)24)20(22-19(21-14)16-9-5-3-6-10-16)26-13-17(25)23-11-7-4-8-12-23/h3,5-6,9-10H,4,7-8,11-13H2,1-2H3