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

Systemtic Name: N-[[4-[bis(prop-2-enyl)sulfamoyl]phenyl]carbamothioyl]-3-bromanyl-4-hexoxy-benzamide Openeye Name: 3-bromo-N-[[4-(diallylsulfamoyl)phenyl]carbamothioyl]-4-hexoxy-benzamide CAS Name: N-[[4-[bis(prop-2-enyl)sulfamoyl]anilino]-sulfanylidenemethyl]-3-bromo-4-hexoxybenzamide IUPAC Name: N-[[4-[bis(prop-2-enyl)sulfamoyl]phenyl]carbamothioyl]-3-bromo-4-hexoxybenzamide Traditional Name: 3-bromo-N-[[4-(diallylsulfamoyl)phenyl]thiocarbamoyl]-4-hexoxy-benzamide Formula: C26H32BrN3O4S2 MolecularWeight: 594.58398

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=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

CCCCCCOC1=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/C26H32BrN3O4S2/c1-4-7-8-9-18-34-24-15-10-20(19-23(24)27)25(31)29-26(35)28-21-11-13-22(14-12-21)36(32,33)30(16-5-2)17-6-3/h5-6,10-15,19H,2-4,7-9,16-18H2,1H3,(H2,28,29,31,35)