2-(1-adamantylsulfanyl)-N-(2,5-dimethylphenyl)ethanamide

Systemtic Name: 2-(1-adamantylsulfanyl)-N-(2,5-dimethylphenyl)ethanamide Openeye Name: 2-(1-adamantylsulfanyl)-N-(2,5-dimethylphenyl)acetamide CAS Name: 2-(1-adamantylthio)-N-(2,5-dimethylphenyl)acetamide IUPAC Name: 2-(1-adamantylsulfanyl)-N-(2,5-dimethylphenyl)acetamide Traditional Name: 2-(1-adamantylthio)-N-(2,5-dimethylphenyl)acetamide Formula: C20H27NOS MolecularWeight: 329.49948

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=O)CSC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=O)CSC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C20H27NOS/c1-13-3-4-14(2)18(5-13)21-19(22)12-23-20-9-15-6-16(10-20)8-17(7-15)11-20/h3-5,15-17H,6-12H2,1-2H3,(H,21,22)