N-(1-adamantyl)-3-(4-methylphenyl)sulfanyl-propanamide

Systemtic Name: N-(1-adamantyl)-3-(4-methylphenyl)sulfanyl-propanamide Openeye Name: N-(1-adamantyl)-3-(p-tolylsulfanyl)propanamide CAS Name: N-(1-adamantyl)-3-[(4-methylphenyl)thio]propanamide IUPAC Name: N-(1-adamantyl)-3-(4-methylphenyl)sulfanylpropanamide Traditional Name: N-(1-adamantyl)-3-(p-tolylthio)propionamide Formula: C20H27NOS MolecularWeight: 329.49948

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCC(=O)NC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CC1=CC=C(C=C1)SCCC(=O)NC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C20H27NOS/c1-14-2-4-18(5-3-14)23-7-6-19(22)21-20-11-15-8-16(12-20)10-17(9-15)13-20/h2-5,15-17H,6-13H2,1H3,(H,21,22)