3-(4-chlorophenyl)-N-(2-ethylsulfanylethyl)adamantane-1-carboxamide

Systemtic Name: 3-(4-chlorophenyl)-N-(2-ethylsulfanylethyl)adamantane-1-carboxamide Openeye Name: 3-(4-chlorophenyl)-N-(2-ethylsulfanylethyl)adamantane-1-carboxamide CAS Name: 3-(4-chlorophenyl)-N-[2-(ethylthio)ethyl]-1-adamantanecarboxamide IUPAC Name: 3-(4-chlorophenyl)-N-(2-ethylsulfanylethyl)adamantane-1-carboxamide Traditional Name: 3-(4-chlorophenyl)-N-[2-(ethylthio)ethyl]adamantane-1-carboxamide Formula: C21H28ClNOS MolecularWeight: 377.97112

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Descriptors Computed from Structure

Canonical SMILES:

CCSCCNC(=O)C12CC3CC(C1)CC(C3)(C2)C4=CC=C(C=C4)Cl

Isomeric SMILES

CCSCCNC(=O)C12CC3CC(C1)CC(C3)(C2)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H28ClNOS/c1-2-25-8-7-23-19(24)21-12-15-9-16(13-21)11-20(10-15,14-21)17-3-5-18(22)6-4-17/h3-6,15-16H,2,7-14H2,1H3,(H,23,24)