2-[4-chloranyl-6-(4-methylpiperazin-1-yl)pyrimidin-2-yl]sulfanyl-N-(2-pyridin-2-ylethyl)ethanamide

Systemtic Name: 2-[4-chloranyl-6-(4-methylpiperazin-1-yl)pyrimidin-2-yl]sulfanyl-N-(2-pyridin-2-ylethyl)ethanamide Openeye Name: 2-[4-chloro-6-(4-methylpiperazin-1-yl)pyrimidin-2-yl]sulfanyl-N-[2-(2-pyridyl)ethyl]acetamide CAS Name: 2-[[4-chloro-6-(4-methyl-1-piperazinyl)-2-pyrimidinyl]thio]-N-[2-(2-pyridinyl)ethyl]acetamide IUPAC Name: 2-[4-chloro-6-(4-methylpiperazin-1-yl)pyrimidin-2-yl]sulfanyl-N-(2-pyridin-2-ylethyl)acetamide Traditional Name: 2-[[4-chloro-6-(4-methylpiperazino)pyrimidin-2-yl]thio]-N-[2-(2-pyridyl)ethyl]acetamide Formula: C18H23ClN6OS MolecularWeight: 406.93282

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=CC(=NC(=N2)SCC(=O)NCCC3=CC=CC=N3)Cl

Isomeric SMILES

CN1CCN(CC1)C2=CC(=NC(=N2)SCC(=O)NCCC3=CC=CC=N3)Cl

InChI

InChI=1S/C18H23ClN6OS/c1-24-8-10-25(11-9-24)16-12-15(19)22-18(23-16)27-13-17(26)21-7-5-14-4-2-3-6-20-14/h2-4,6,12H,5,7-11,13H2,1H3,(H,21,26)