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

Systemtic Name: N-(6-azanylhexyl)-2-[4-chloranyl-6-(diethylamino)pyrimidin-2-yl]sulfanyl-ethanamide Openeye Name: N-(6-aminohexyl)-2-[4-chloro-6-(diethylamino)pyrimidin-2-yl]sulfanyl-acetamide CAS Name: N-(6-aminohexyl)-2-[[4-chloro-6-(diethylamino)-2-pyrimidinyl]thio]acetamide IUPAC Name: N-(6-aminohexyl)-2-[4-chloro-6-(diethylamino)pyrimidin-2-yl]sulfanylacetamide Traditional Name: N-(6-aminohexyl)-2-[[4-chloro-6-(diethylamino)pyrimidin-2-yl]thio]acetamide Formula: C16H28ClN5OS MolecularWeight: 373.94442

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC(=NC(=N1)SCC(=O)NCCCCCCN)Cl

Isomeric SMILES

CCN(CC)C1=CC(=NC(=N1)SCC(=O)NCCCCCCN)Cl

InChI

InChI=1S/C16H28ClN5OS/c1-3-22(4-2)14-11-13(17)20-16(21-14)24-12-15(23)19-10-8-6-5-7-9-18/h11H,3-10,12,18H2,1-2H3,(H,19,23)