N-(1-adamantyl)-2-(4-bromanyl-2,5-dimethyl-phenyl)sulfanyl-ethanamide

Systemtic Name: N-(1-adamantyl)-2-(4-bromanyl-2,5-dimethyl-phenyl)sulfanyl-ethanamide Openeye Name: N-(1-adamantyl)-2-(4-bromo-2,5-dimethyl-phenyl)sulfanyl-acetamide CAS Name: N-(1-adamantyl)-2-[(4-bromo-2,5-dimethylphenyl)thio]acetamide IUPAC Name: N-(1-adamantyl)-2-(4-bromo-2,5-dimethylphenyl)sulfanylacetamide Traditional Name: N-(1-adamantyl)-2-[(4-bromo-2,5-dimethyl-phenyl)thio]acetamide Formula: C20H26BrNOS MolecularWeight: 408.39554

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Br)C)SCC(=O)NC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CC1=CC(=C(C=C1Br)C)SCC(=O)NC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C20H26BrNOS/c1-12-4-18(13(2)3-17(12)21)24-11-19(23)22-20-8-14-5-15(9-20)7-16(6-14)10-20/h3-4,14-16H,5-11H2,1-2H3,(H,22,23)