1-(1-adamantyl)-2-(3,4-dichlorophenyl)sulfanyl-ethanol

Systemtic Name: 1-(1-adamantyl)-2-(3,4-dichlorophenyl)sulfanyl-ethanol Openeye Name: 1-(1-adamantyl)-2-(3,4-dichlorophenyl)sulfanyl-ethanol CAS Name: 1-(1-adamantyl)-2-[(3,4-dichlorophenyl)thio]ethanol IUPAC Name: 1-(1-adamantyl)-2-(3,4-dichlorophenyl)sulfanylethanol Traditional Name: 1-(1-adamantyl)-2-[(3,4-dichlorophenyl)thio]ethanol Formula: C18H22Cl2OS MolecularWeight: 357.33768

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(CSC4=CC(=C(C=C4)Cl)Cl)O

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(CSC4=CC(=C(C=C4)Cl)Cl)O

InChI

InChI=1S/C18H22Cl2OS/c19-15-2-1-14(6-16(15)20)22-10-17(21)18-7-11-3-12(8-18)5-13(4-11)9-18/h1-2,6,11-13,17,21H,3-5,7-10H2