2-[4-chloranyl-6-(4-methylpiperidin-1-yl)pyrimidin-2-yl]sulfanyl-N-[(1R)-1-phenylethyl]ethanamide

Systemtic Name: 2-[4-chloranyl-6-(4-methylpiperidin-1-yl)pyrimidin-2-yl]sulfanyl-N-[(1R)-1-phenylethyl]ethanamide Openeye Name: 2-[4-chloro-6-(4-methyl-1-piperidyl)pyrimidin-2-yl]sulfanyl-N-[(1R)-1-phenylethyl]acetamide CAS Name: 2-[[4-chloro-6-(4-methyl-1-piperidinyl)-2-pyrimidinyl]thio]-N-[(1R)-1-phenylethyl]acetamide IUPAC Name: 2-[4-chloro-6-(4-methylpiperidin-1-yl)pyrimidin-2-yl]sulfanyl-N-[(1R)-1-phenylethyl]acetamide Traditional Name: 2-[[4-chloro-6-(4-methylpiperidino)pyrimidin-2-yl]thio]-N-[(1R)-1-phenylethyl]acetamide Formula: C20H25ClN4OS MolecularWeight: 404.9567

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=CC(=NC(=N2)SCC(=O)NC(C)C3=CC=CC=C3)Cl

Isomeric SMILES

CC1CCN(CC1)C2=CC(=NC(=N2)SCC(=O)N[C@H](C)C3=CC=CC=C3)Cl

InChI

InChI=1S/C20H25ClN4OS/c1-14-8-10-25(11-9-14)18-12-17(21)23-20(24-18)27-13-19(26)22-15(2)16-6-4-3-5-7-16/h3-7,12,14-15H,8-11,13H2,1-2H3,(H,22,26)/t15-/m1/s1