N-[[4-[bis(prop-2-enyl)sulfamoyl]phenyl]carbamothioyl]-3-bromanyl-4-ethoxy-benzamide

Systemtic Name: N-[[4-[bis(prop-2-enyl)sulfamoyl]phenyl]carbamothioyl]-3-bromanyl-4-ethoxy-benzamide Openeye Name: 3-bromo-N-[[4-(diallylsulfamoyl)phenyl]carbamothioyl]-4-ethoxy-benzamide CAS Name: N-[[4-[bis(prop-2-enyl)sulfamoyl]anilino]-sulfanylidenemethyl]-3-bromo-4-ethoxybenzamide IUPAC Name: N-[[4-[bis(prop-2-enyl)sulfamoyl]phenyl]carbamothioyl]-3-bromo-4-ethoxybenzamide Traditional Name: 3-bromo-N-[[4-(diallylsulfamoyl)phenyl]thiocarbamoyl]-4-ethoxy-benzamide Formula: C22H24BrN3O4S2 MolecularWeight: 538.47766

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H24BrN3O4S2/c1-4-13-26(14-5-2)32(28,29)18-10-8-17(9-11-18)24-22(31)25-21(27)16-7-12-20(30-6-3)19(23)15-16/h4-5,7-12,15H,1-2,6,13-14H2,3H3,(H2,24,25,27,31)