2-[3-chloranyl-4-[3-(3-oxidanyl-4-propanoyl-2-propyl-phenoxy)propylsulfanyl]phenyl]ethanamide

Systemtic Name: 2-[3-chloranyl-4-[3-(3-oxidanyl-4-propanoyl-2-propyl-phenoxy)propylsulfanyl]phenyl]ethanamide Openeye Name: 2-[3-chloro-4-[3-(3-hydroxy-4-propanoyl-2-propyl-phenoxy)propylsulfanyl]phenyl]acetamide CAS Name: 2-[3-chloro-4-[3-[3-hydroxy-4-(1-oxopropyl)-2-propylphenoxy]propylthio]phenyl]acetamide IUPAC Name: 2-[3-chloro-4-[3-(3-hydroxy-4-propanoyl-2-propylphenoxy)propylsulfanyl]phenyl]acetamide Traditional Name: 2-[3-chloro-4-[3-(3-hydroxy-4-propionyl-2-propyl-phenoxy)propylthio]phenyl]acetamide Formula: C23H28ClNO4S MolecularWeight: 449.99072

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C(=O)CC)OCCCSC2=C(C=C(C=C2)CC(=O)N)Cl

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C(=O)CC)OCCCSC2=C(C=C(C=C2)CC(=O)N)Cl

InChI

InChI=1S/C23H28ClNO4S/c1-3-6-17-20(9-8-16(23(17)28)19(26)4-2)29-11-5-12-30-21-10-7-15(13-18(21)24)14-22(25)27/h7-10,13,28H,3-6,11-12,14H2,1-2H3,(H2,25,27)