N-[[1-[[4-(2-methylsulfanylethyl)phenyl]methyl]cyclobutyl]methyl]naphthalene-1-sulfonamide

Systemtic Name: N-[[1-[[4-(2-methylsulfanylethyl)phenyl]methyl]cyclobutyl]methyl]naphthalene-1-sulfonamide Openeye Name: N-[[1-[[4-(2-methylsulfanylethyl)phenyl]methyl]cyclobutyl]methyl]naphthalene-1-sulfonamide CAS Name: N-[[1-[[4-[2-(methylthio)ethyl]phenyl]methyl]cyclobutyl]methyl]-1-naphthalenesulfonamide IUPAC Name: N-[[1-[[4-(2-methylsulfanylethyl)phenyl]methyl]cyclobutyl]methyl]naphthalene-1-sulfonamide Traditional Name: N-[[1-[4-[2-(methylthio)ethyl]benzyl]cyclobutyl]methyl]naphthalene-1-sulfonamide Formula: C25H29NO2S2 MolecularWeight: 439.63326

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC1=CC=C(C=C1)CC2(CCC2)CNS(=O)(=O)C3=CC=CC4=CC=CC=C43

Isomeric SMILES

CSCCC1=CC=C(C=C1)CC2(CCC2)CNS(=O)(=O)C3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C25H29NO2S2/c1-29-17-14-20-10-12-21(13-11-20)18-25(15-5-16-25)19-26-30(27,28)24-9-4-7-22-6-2-3-8-23(22)24/h2-4,6-13,26H,5,14-19H2,1H3