N-[2-chloranyl-1-[6-methylsulfanyl-3,4-bis(oxidanyl)oxan-2-yl]propyl]-5-fluoranyl-5-propyl-azepane-2-carboxamide

Systemtic Name: N-[2-chloranyl-1-[6-methylsulfanyl-3,4-bis(oxidanyl)oxan-2-yl]propyl]-5-fluoranyl-5-propyl-azepane-2-carboxamide Openeye Name: N-[2-chloro-1-(3,4-dihydroxy-6-methylsulfanyl-tetrahydropyran-2-yl)propyl]-5-fluoro-5-propyl-azepane-2-carboxamide CAS Name: N-[2-chloro-1-[3,4-dihydroxy-6-(methylthio)-2-oxanyl]propyl]-5-fluoro-5-propyl-2-azepanecarboxamide IUPAC Name: N-[2-chloro-1-(3,4-dihydroxy-6-methylsulfanyloxan-2-yl)propyl]-5-fluoro-5-propylazepane-2-carboxamide Traditional Name: N-[2-chloro-1-[3,4-dihydroxy-6-(methylthio)tetrahydropyran-2-yl]propyl]-5-fluoro-5-propyl-azepane-2-carboxamide Formula: C19H34ClFN2O4S MolecularWeight: 441.000663

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1(CCC(NCC1)C(=O)NC(C2C(C(CC(O2)SC)O)O)C(C)Cl)F

Isomeric SMILES

CCCC1(CCC(NCC1)C(=O)NC(C2C(C(CC(O2)SC)O)O)C(C)Cl)F

InChI

InChI=1S/C19H34ClFN2O4S/c1-4-6-19(21)7-5-12(22-9-8-19)18(26)23-15(11(2)20)17-16(25)13(24)10-14(27-17)28-3/h11-17,22,24-25H,4-10H2,1-3H3,(H,23,26)