N-[2-[2-(4-methylphenyl)sulfanylethylamino]-2-oxidanylidene-ethyl]adamantane-1-carboxamide

Systemtic Name: N-[2-[2-(4-methylphenyl)sulfanylethylamino]-2-oxidanylidene-ethyl]adamantane-1-carboxamide Openeye Name: N-[2-oxo-2-[2-(p-tolylsulfanyl)ethylamino]ethyl]adamantane-1-carboxamide CAS Name: N-[2-[2-[(4-methylphenyl)thio]ethylamino]-2-oxoethyl]-1-adamantanecarboxamide IUPAC Name: N-[2-[2-(4-methylphenyl)sulfanylethylamino]-2-oxoethyl]adamantane-1-carboxamide Traditional Name: N-[2-keto-2-[2-(p-tolylthio)ethylamino]ethyl]adamantane-1-carboxamide Formula: C22H30N2O2S MolecularWeight: 386.5508

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCNC(=O)CNC(=O)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CC1=CC=C(C=C1)SCCNC(=O)CNC(=O)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C22H30N2O2S/c1-15-2-4-19(5-3-15)27-7-6-23-20(25)14-24-21(26)22-11-16-8-17(12-22)10-18(9-16)13-22/h2-5,16-18H,6-14H2,1H3,(H,23,25)(H,24,26)