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

Systemtic Name: N-(6-azanylhexyl)-2-[4-chloranyl-6-(4-methylpiperidin-1-yl)pyrimidin-2-yl]sulfanyl-ethanamide Openeye Name: N-(6-aminohexyl)-2-[4-chloro-6-(4-methyl-1-piperidyl)pyrimidin-2-yl]sulfanyl-acetamide CAS Name: N-(6-aminohexyl)-2-[[4-chloro-6-(4-methyl-1-piperidinyl)-2-pyrimidinyl]thio]acetamide IUPAC Name: N-(6-aminohexyl)-2-[4-chloro-6-(4-methylpiperidin-1-yl)pyrimidin-2-yl]sulfanylacetamide Traditional Name: N-(6-aminohexyl)-2-[[4-chloro-6-(4-methylpiperidino)pyrimidin-2-yl]thio]acetamide Formula: C18H30ClN5OS MolecularWeight: 399.9817

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H30ClN5OS/c1-14-6-10-24(11-7-14)16-12-15(19)22-18(23-16)26-13-17(25)21-9-5-3-2-4-8-20/h12,14H,2-11,13,20H2,1H3,(H,21,25)