N-(1-adamantylmethyl)-2-chloranyl-5-[2-(3-oxidanylpropylsulfanyl)ethoxy]benzamide

Systemtic Name: N-(1-adamantylmethyl)-2-chloranyl-5-[2-(3-oxidanylpropylsulfanyl)ethoxy]benzamide Openeye Name: N-(1-adamantylmethyl)-2-chloro-5-[2-(3-hydroxypropylsulfanyl)ethoxy]benzamide CAS Name: N-(1-adamantylmethyl)-2-chloro-5-[2-(3-hydroxypropylthio)ethoxy]benzamide IUPAC Name: N-(1-adamantylmethyl)-2-chloro-5-[2-(3-hydroxypropylsulfanyl)ethoxy]benzamide Traditional Name: N-(1-adamantylmethyl)-2-chloro-5-[2-(3-hydroxypropylthio)ethoxy]benzamide Formula: C23H32ClNO3S MolecularWeight: 438.02308

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)CNC(=O)C4=C(C=CC(=C4)OCCSCCCO)Cl

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)CNC(=O)C4=C(C=CC(=C4)OCCSCCCO)Cl

InChI

InChI=1S/C23H32ClNO3S/c24-21-3-2-19(28-5-7-29-6-1-4-26)11-20(21)22(27)25-15-23-12-16-8-17(13-23)10-18(9-16)14-23/h2-3,11,16-18,26H,1,4-10,12-15H2,(H,25,27)