5-bromanyl-2-(3-methylbutoxy)-N-[(4-sulfamoylphenyl)carbamothioyl]benzamide

Systemtic Name: 5-bromanyl-2-(3-methylbutoxy)-N-[(4-sulfamoylphenyl)carbamothioyl]benzamide Openeye Name: 5-bromo-2-isopentyloxy-N-[(4-sulfamoylphenyl)carbamothioyl]benzamide CAS Name: 5-bromo-2-(3-methylbutoxy)-N-[(4-sulfamoylanilino)-sulfanylidenemethyl]benzamide IUPAC Name: 5-bromo-2-(3-methylbutoxy)-N-[(4-sulfamoylphenyl)carbamothioyl]benzamide Traditional Name: 5-bromo-2-isoamoxy-N-[(4-sulfamoylphenyl)thiocarbamoyl]benzamide Formula: C19H22BrN3O4S2 MolecularWeight: 500.42968

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=C(C=C(C=C1)Br)C(=O)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)N

Isomeric SMILES

CC(C)CCOC1=C(C=C(C=C1)Br)C(=O)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)N

InChI

InChI=1S/C19H22BrN3O4S2/c1-12(2)9-10-27-17-8-3-13(20)11-16(17)18(24)23-19(28)22-14-4-6-15(7-5-14)29(21,25)26/h3-8,11-12H,9-10H2,1-2H3,(H2,21,25,26)(H2,22,23,24,28)