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

Systemtic Name: N-(6-azanylhexyl)-2-[4-chloranyl-6-(dipropylamino)pyrimidin-2-yl]sulfanyl-ethanamide Openeye Name: N-(6-aminohexyl)-2-[4-chloro-6-(dipropylamino)pyrimidin-2-yl]sulfanyl-acetamide CAS Name: N-(6-aminohexyl)-2-[[4-chloro-6-(dipropylamino)-2-pyrimidinyl]thio]acetamide IUPAC Name: N-(6-aminohexyl)-2-[4-chloro-6-(dipropylamino)pyrimidin-2-yl]sulfanylacetamide Traditional Name: N-(6-aminohexyl)-2-[[4-chloro-6-(dipropylamino)pyrimidin-2-yl]thio]acetamide Formula: C18H32ClN5OS MolecularWeight: 401.99758

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)C1=CC(=NC(=N1)SCC(=O)NCCCCCCN)Cl

Isomeric SMILES

CCCN(CCC)C1=CC(=NC(=N1)SCC(=O)NCCCCCCN)Cl

InChI

InChI=1S/C18H32ClN5OS/c1-3-11-24(12-4-2)16-13-15(19)22-18(23-16)26-14-17(25)21-10-8-6-5-7-9-20/h13H,3-12,14,20H2,1-2H3,(H,21,25)