N-[2-(1-adamantylsulfanyl)ethanoyl]-2-methoxy-benzamide

Systemtic Name: N-[2-(1-adamantylsulfanyl)ethanoyl]-2-methoxy-benzamide Openeye Name: N-[2-(1-adamantylsulfanyl)acetyl]-2-methoxy-benzamide CAS Name: N-[2-(1-adamantylthio)-1-oxoethyl]-2-methoxybenzamide IUPAC Name: N-[2-(1-adamantylsulfanyl)acetyl]-2-methoxybenzamide Traditional Name: N-[2-(1-adamantylthio)acetyl]-2-methoxy-benzamide Formula: C20H25NO3S MolecularWeight: 359.4824

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(=O)NC(=O)CSC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

COC1=CC=CC=C1C(=O)NC(=O)CSC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C20H25NO3S/c1-24-17-5-3-2-4-16(17)19(23)21-18(22)12-25-20-9-13-6-14(10-20)8-15(7-13)11-20/h2-5,13-15H,6-12H2,1H3,(H,21,22,23)