2-[2-(1-adamantylamino)-2-oxidanylidene-ethyl]sulfinyl-N-(4-methylphenyl)ethanamide

Systemtic Name: 2-[2-(1-adamantylamino)-2-oxidanylidene-ethyl]sulfinyl-N-(4-methylphenyl)ethanamide Openeye Name: 2-[2-(1-adamantylamino)-2-oxo-ethyl]sulfinyl-N-(p-tolyl)acetamide CAS Name: 2-[2-(1-adamantylamino)-2-oxoethyl]sulfinyl-N-(4-methylphenyl)acetamide IUPAC Name: 2-[2-(1-adamantylamino)-2-oxoethyl]sulfinyl-N-(4-methylphenyl)acetamide Traditional Name: 2-[2-(1-adamantylamino)-2-keto-ethyl]sulfinyl-N-(p-tolyl)acetamide Formula: C21H28N2O3S MolecularWeight: 388.52362

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H28N2O3S/c1-14-2-4-18(5-3-14)22-19(24)12-27(26)13-20(25)23-21-9-15-6-16(10-21)8-17(7-15)11-21/h2-5,15-17H,6-13H2,1H3,(H,22,24)(H,23,25)