N-(3-methylsulfanylphenyl)adamantane-2-carboxamide

Systemtic Name: N-(3-methylsulfanylphenyl)adamantane-2-carboxamide Openeye Name: N-(3-methylsulfanylphenyl)adamantane-2-carboxamide CAS Name: N-[3-(methylthio)phenyl]-2-adamantanecarboxamide IUPAC Name: N-(3-methylsulfanylphenyl)adamantane-2-carboxamide Traditional Name: N-[3-(methylthio)phenyl]adamantane-2-carboxamide Formula: C18H23NOS MolecularWeight: 301.44632

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC(=C1)NC(=O)C2C3CC4CC(C3)CC2C4

Isomeric SMILES

CSC1=CC=CC(=C1)NC(=O)C2C3CC4CC(C3)CC2C4

InChI

InChI=1S/C18H23NOS/c1-21-16-4-2-3-15(10-16)19-18(20)17-13-6-11-5-12(8-13)9-14(17)7-11/h2-4,10-14,17H,5-9H2,1H3,(H,19,20)