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

Systemtic Name: 2-[4-chloranyl-6-[cyclohexyl(methyl)amino]pyrimidin-2-yl]sulfanyl-N-hexyl-ethanamide Openeye Name: 2-[4-chloro-6-[cyclohexyl(methyl)amino]pyrimidin-2-yl]sulfanyl-N-hexyl-acetamide CAS Name: 2-[[4-chloro-6-[cyclohexyl(methyl)amino]-2-pyrimidinyl]thio]-N-hexylacetamide IUPAC Name: 2-[4-chloro-6-[cyclohexyl(methyl)amino]pyrimidin-2-yl]sulfanyl-N-hexylacetamide Traditional Name: 2-[[4-chloro-6-[cyclohexyl(methyl)amino]pyrimidin-2-yl]thio]-N-hexyl-acetamide Formula: C19H31ClN4OS MolecularWeight: 398.99364

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC(=O)CSC1=NC(=CC(=N1)Cl)N(C)C2CCCCC2

Isomeric SMILES

CCCCCCNC(=O)CSC1=NC(=CC(=N1)Cl)N(C)C2CCCCC2

InChI

InChI=1S/C19H31ClN4OS/c1-3-4-5-9-12-21-18(25)14-26-19-22-16(20)13-17(23-19)24(2)15-10-7-6-8-11-15/h13,15H,3-12,14H2,1-2H3,(H,21,25)