N-[[5-(methylsulfanylmethyl)furan-2-yl]methyl]-4-methylsulfonyl-aniline

Systemtic Name: N-[[5-(methylsulfanylmethyl)furan-2-yl]methyl]-4-methylsulfonyl-aniline Openeye Name: N-[[5-(methylsulfanylmethyl)-2-furyl]methyl]-4-methylsulfonyl-aniline CAS Name: 4-methylsulfonyl-N-[[5-[(methylthio)methyl]-2-furanyl]methyl]aniline IUPAC Name: N-[[5-(methylsulfanylmethyl)furan-2-yl]methyl]-4-methylsulfonylaniline Traditional Name: (4-mesylphenyl)-[[5-[(methylthio)methyl]-2-furyl]methyl]amine Formula: C14H17NO3S2 MolecularWeight: 311.41968

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Descriptors Computed from Structure

Canonical SMILES:

CSCC1=CC=C(O1)CNC2=CC=C(C=C2)S(=O)(=O)C

Isomeric SMILES

CSCC1=CC=C(O1)CNC2=CC=C(C=C2)S(=O)(=O)C

InChI

InChI=1S/C14H17NO3S2/c1-19-10-13-6-5-12(18-13)9-15-11-3-7-14(8-4-11)20(2,16)17/h3-8,15H,9-10H2,1-2H3