N-(3,4-dichlorophenyl)-4-methoxy-3-[(4-sulfamoylphenyl)carbamothioylamino]benzamide

Systemtic Name: N-(3,4-dichlorophenyl)-4-methoxy-3-[(4-sulfamoylphenyl)carbamothioylamino]benzamide Openeye Name: N-(3,4-dichlorophenyl)-4-methoxy-3-[(4-sulfamoylphenyl)carbamothioylamino]benzamide CAS Name: N-(3,4-dichlorophenyl)-4-methoxy-3-[[(4-sulfamoylanilino)-sulfanylidenemethyl]amino]benzamide IUPAC Name: N-(3,4-dichlorophenyl)-4-methoxy-3-[(4-sulfamoylphenyl)carbamothioylamino]benzamide Traditional Name: N-(3,4-dichlorophenyl)-4-methoxy-3-[(4-sulfamoylphenyl)thiocarbamoylamino]benzamide Formula: C21H18Cl2N4O4S2 MolecularWeight: 525.42802

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC2=CC(=C(C=C2)Cl)Cl)NC(=S)NC3=CC=C(C=C3)S(=O)(=O)N

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC2=CC(=C(C=C2)Cl)Cl)NC(=S)NC3=CC=C(C=C3)S(=O)(=O)N

InChI

InChI=1S/C21H18Cl2N4O4S2/c1-31-19-9-2-12(20(28)25-14-5-8-16(22)17(23)11-14)10-18(19)27-21(32)26-13-3-6-15(7-4-13)33(24,29)30/h2-11H,1H3,(H,25,28)(H2,24,29,30)(H2,26,27,32)