2-(4-chloranyl-6-pyrrolidin-1-yl-pyrimidin-2-yl)sulfanyl-1-(4-methylpiperidin-1-yl)ethanone

Systemtic Name: 2-(4-chloranyl-6-pyrrolidin-1-yl-pyrimidin-2-yl)sulfanyl-1-(4-methylpiperidin-1-yl)ethanone Openeye Name: 2-(4-chloro-6-pyrrolidin-1-yl-pyrimidin-2-yl)sulfanyl-1-(4-methyl-1-piperidyl)ethanone CAS Name: 2-[[4-chloro-6-(1-pyrrolidinyl)-2-pyrimidinyl]thio]-1-(4-methyl-1-piperidinyl)ethanone IUPAC Name: 2-(4-chloro-6-pyrrolidin-1-ylpyrimidin-2-yl)sulfanyl-1-(4-methylpiperidin-1-yl)ethanone Traditional Name: 2-[(4-chloro-6-pyrrolidino-pyrimidin-2-yl)thio]-1-(4-methylpiperidino)ethanone Formula: C16H23ClN4OS MolecularWeight: 354.89802

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=O)CSC2=NC(=CC(=N2)Cl)N3CCCC3

Isomeric SMILES

CC1CCN(CC1)C(=O)CSC2=NC(=CC(=N2)Cl)N3CCCC3

InChI

InChI=1S/C16H23ClN4OS/c1-12-4-8-21(9-5-12)15(22)11-23-16-18-13(17)10-14(19-16)20-6-2-3-7-20/h10,12H,2-9,11H2,1H3