5-[2-(1-adamantylsulfanyl)ethanoyl]-1-methyl-3H-indol-2-one

Systemtic Name: 5-[2-(1-adamantylsulfanyl)ethanoyl]-1-methyl-3H-indol-2-one Openeye Name: 5-[2-(1-adamantylsulfanyl)acetyl]-1-methyl-indolin-2-one CAS Name: 5-[2-(1-adamantylthio)-1-oxoethyl]-1-methyl-3H-indol-2-one IUPAC Name: 5-[2-(1-adamantylsulfanyl)acetyl]-1-methyl-3H-indol-2-one Traditional Name: 5-[2-(1-adamantylthio)acetyl]-1-methyl-oxindole Formula: C21H25NO2S MolecularWeight: 355.4937

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)CC2=C1C=CC(=C2)C(=O)CSC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CN1C(=O)CC2=C1C=CC(=C2)C(=O)CSC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C21H25NO2S/c1-22-18-3-2-16(7-17(18)8-20(22)24)19(23)12-25-21-9-13-4-14(10-21)6-15(5-13)11-21/h2-3,7,13-15H,4-6,8-12H2,1H3