N-[[5-(diethylsulfamoyl)-2-methoxy-phenyl]carbamothioyl]-4-(4-methylphenoxy)butanamide

Systemtic Name: N-[[5-(diethylsulfamoyl)-2-methoxy-phenyl]carbamothioyl]-4-(4-methylphenoxy)butanamide Openeye Name: N-[[5-(diethylsulfamoyl)-2-methoxy-phenyl]carbamothioyl]-4-(4-methylphenoxy)butanamide CAS Name: N-[[5-(diethylsulfamoyl)-2-methoxyanilino]-sulfanylidenemethyl]-4-(4-methylphenoxy)butanamide IUPAC Name: N-[[5-(diethylsulfamoyl)-2-methoxyphenyl]carbamothioyl]-4-(4-methylphenoxy)butanamide Traditional Name: N-[[5-(diethylsulfamoyl)-2-methoxy-phenyl]thiocarbamoyl]-4-(4-methylphenoxy)butyramide Formula: C23H31N3O5S2 MolecularWeight: 493.63934

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)OC)NC(=S)NC(=O)CCCOC2=CC=C(C=C2)C

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)OC)NC(=S)NC(=O)CCCOC2=CC=C(C=C2)C

InChI

InChI=1S/C23H31N3O5S2/c1-5-26(6-2)33(28,29)19-13-14-21(30-4)20(16-19)24-23(32)25-22(27)8-7-15-31-18-11-9-17(3)10-12-18/h9-14,16H,5-8,15H2,1-4H3,(H2,24,25,27,32)