3-chloranyl-N-[2-(phenylmethylsulfanyl)ethyl]adamantane-1-carboxamide

Systemtic Name: 3-chloranyl-N-[2-(phenylmethylsulfanyl)ethyl]adamantane-1-carboxamide Openeye Name: N-(2-benzylsulfanylethyl)-3-chloro-adamantane-1-carboxamide CAS Name: 3-chloro-N-[2-(phenylmethylthio)ethyl]-1-adamantanecarboxamide IUPAC Name: N-(2-benzylsulfanylethyl)-3-chloroadamantane-1-carboxamide Traditional Name: N-[2-(benzylthio)ethyl]-3-chloro-adamantane-1-carboxamide Formula: C20H26ClNOS MolecularWeight: 363.94454

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3(CC1CC(C2)(C3)Cl)C(=O)NCCSCC4=CC=CC=C4

Isomeric SMILES

C1C2CC3(CC1CC(C2)(C3)Cl)C(=O)NCCSCC4=CC=CC=C4

InChI

InChI=1S/C20H26ClNOS/c21-20-11-16-8-17(12-20)10-19(9-16,14-20)18(23)22-6-7-24-13-15-4-2-1-3-5-15/h1-5,16-17H,6-14H2,(H,22,23)