N-butan-2-yl-2-[4-chloranyl-6-[methyl-(1-methylpiperidin-4-yl)amino]pyrimidin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-butan-2-yl-2-[4-chloranyl-6-[methyl-(1-methylpiperidin-4-yl)amino]pyrimidin-2-yl]sulfanyl-ethanamide Openeye Name: 2-[4-chloro-6-[methyl-(1-methyl-4-piperidyl)amino]pyrimidin-2-yl]sulfanyl-N-sec-butyl-acetamide CAS Name: N-butan-2-yl-2-[[4-chloro-6-[methyl-(1-methyl-4-piperidinyl)amino]-2-pyrimidinyl]thio]acetamide IUPAC Name: N-butan-2-yl-2-[4-chloro-6-[methyl-(1-methylpiperidin-4-yl)amino]pyrimidin-2-yl]sulfanylacetamide Traditional Name: 2-[[4-chloro-6-[methyl-(1-methyl-4-piperidyl)amino]pyrimidin-2-yl]thio]-N-sec-butyl-acetamide Formula: C17H28ClN5OS MolecularWeight: 385.95512

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)CSC1=NC(=CC(=N1)Cl)N(C)C2CCN(CC2)C

Isomeric SMILES

CCC(C)NC(=O)CSC1=NC(=CC(=N1)Cl)N(C)C2CCN(CC2)C

InChI

InChI=1S/C17H28ClN5OS/c1-5-12(2)19-16(24)11-25-17-20-14(18)10-15(21-17)23(4)13-6-8-22(3)9-7-13/h10,12-13H,5-9,11H2,1-4H3,(H,19,24)