N-(6-azanylhexyl)-2-[4-chloranyl-6-[cyclohexyl(methyl)amino]pyrimidin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(6-azanylhexyl)-2-[4-chloranyl-6-[cyclohexyl(methyl)amino]pyrimidin-2-yl]sulfanyl-ethanamide Openeye Name: N-(6-aminohexyl)-2-[4-chloro-6-[cyclohexyl(methyl)amino]pyrimidin-2-yl]sulfanyl-acetamide CAS Name: N-(6-aminohexyl)-2-[[4-chloro-6-[cyclohexyl(methyl)amino]-2-pyrimidinyl]thio]acetamide IUPAC Name: N-(6-aminohexyl)-2-[4-chloro-6-[cyclohexyl(methyl)amino]pyrimidin-2-yl]sulfanylacetamide Traditional Name: N-(6-aminohexyl)-2-[[4-chloro-6-[cyclohexyl(methyl)amino]pyrimidin-2-yl]thio]acetamide Formula: C19H32ClN5OS MolecularWeight: 414.00828

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCCCC1)C2=CC(=NC(=N2)SCC(=O)NCCCCCCN)Cl

Isomeric SMILES

CN(C1CCCCC1)C2=CC(=NC(=N2)SCC(=O)NCCCCCCN)Cl

InChI

InChI=1S/C19H32ClN5OS/c1-25(15-9-5-4-6-10-15)17-13-16(20)23-19(24-17)27-14-18(26)22-12-8-3-2-7-11-21/h13,15H,2-12,14,21H2,1H3,(H,22,26)