2-[4-chloranyl-6-[methyl-(1-methylpiperidin-4-yl)amino]pyrimidin-2-yl]sulfanyl-1-piperidin-1-yl-ethanone

Systemtic Name: 2-[4-chloranyl-6-[methyl-(1-methylpiperidin-4-yl)amino]pyrimidin-2-yl]sulfanyl-1-piperidin-1-yl-ethanone Openeye Name: 2-[4-chloro-6-[methyl-(1-methyl-4-piperidyl)amino]pyrimidin-2-yl]sulfanyl-1-(1-piperidyl)ethanone CAS Name: 2-[[4-chloro-6-[methyl-(1-methyl-4-piperidinyl)amino]-2-pyrimidinyl]thio]-1-(1-piperidinyl)ethanone IUPAC Name: 2-[4-chloro-6-[methyl-(1-methylpiperidin-4-yl)amino]pyrimidin-2-yl]sulfanyl-1-piperidin-1-ylethanone Traditional Name: 2-[[4-chloro-6-[methyl-(1-methyl-4-piperidyl)amino]pyrimidin-2-yl]thio]-1-piperidino-ethanone Formula: C18H28ClN5OS MolecularWeight: 397.96582

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1)N(C)C2=CC(=NC(=N2)SCC(=O)N3CCCCC3)Cl

Isomeric SMILES

CN1CCC(CC1)N(C)C2=CC(=NC(=N2)SCC(=O)N3CCCCC3)Cl

InChI

InChI=1S/C18H28ClN5OS/c1-22-10-6-14(7-11-22)23(2)16-12-15(19)20-18(21-16)26-13-17(25)24-8-4-3-5-9-24/h12,14H,3-11,13H2,1-2H3