N4,N4-diethyl-N1-(3-methylsulfanylphenyl)benzene-1,4-disulfonamide

Systemtic Name: N4,N4-diethyl-N1-(3-methylsulfanylphenyl)benzene-1,4-disulfonamide Openeye Name: N4,N4-diethyl-N1-(3-methylsulfanylphenyl)benzene-1,4-disulfonamide CAS Name: N4,N4-diethyl-N1-[3-(methylthio)phenyl]benzene-1,4-disulfonamide IUPAC Name: 4-N,4-N-diethyl-1-N-(3-methylsulfanylphenyl)benzene-1,4-disulfonamide Traditional Name: N',N'-diethyl-N-[3-(methylthio)phenyl]benzene-1,4-disulfonamide Formula: C17H22N2O4S3 MolecularWeight: 414.56258

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)NC2=CC(=CC=C2)SC

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)NC2=CC(=CC=C2)SC

InChI

InChI=1S/C17H22N2O4S3/c1-4-19(5-2)26(22,23)17-11-9-16(10-12-17)25(20,21)18-14-7-6-8-15(13-14)24-3/h6-13,18H,4-5H2,1-3H3