4-butoxy-N-[(4-methylsulfanylphenyl)methyl]benzenesulfonamide

Systemtic Name: 4-butoxy-N-[(4-methylsulfanylphenyl)methyl]benzenesulfonamide Openeye Name: 4-butoxy-N-[(4-methylsulfanylphenyl)methyl]benzenesulfonamide CAS Name: 4-butoxy-N-[[4-(methylthio)phenyl]methyl]benzenesulfonamide IUPAC Name: 4-butoxy-N-[(4-methylsulfanylphenyl)methyl]benzenesulfonamide Traditional Name: 4-butoxy-N-[4-(methylthio)benzyl]benzenesulfonamide Formula: C18H23NO3S2 MolecularWeight: 365.51012

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)S(=O)(=O)NCC2=CC=C(C=C2)SC

Isomeric SMILES

CCCCOC1=CC=C(C=C1)S(=O)(=O)NCC2=CC=C(C=C2)SC

InChI

InChI=1S/C18H23NO3S2/c1-3-4-13-22-16-7-11-18(12-8-16)24(20,21)19-14-15-5-9-17(23-2)10-6-15/h5-12,19H,3-4,13-14H2,1-2H3