3-bromanyl-4-hexoxy-N-[[4-[methyl-(phenylmethyl)sulfamoyl]phenyl]carbamothioyl]benzamide

Systemtic Name: 3-bromanyl-4-hexoxy-N-[[4-[methyl-(phenylmethyl)sulfamoyl]phenyl]carbamothioyl]benzamide Openeye Name: N-[[4-[benzyl(methyl)sulfamoyl]phenyl]carbamothioyl]-3-bromo-4-hexoxy-benzamide CAS Name: 3-bromo-4-hexoxy-N-[[4-[methyl-(phenylmethyl)sulfamoyl]anilino]-sulfanylidenemethyl]benzamide IUPAC Name: N-[[4-[benzyl(methyl)sulfamoyl]phenyl]carbamothioyl]-3-bromo-4-hexoxybenzamide Traditional Name: N-[[4-[benzyl(methyl)sulfamoyl]phenyl]thiocarbamoyl]-3-bromo-4-hexoxy-benzamide Formula: C28H32BrN3O4S2 MolecularWeight: 618.60538

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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(C)CC3=CC=CC=C3)Br

Isomeric SMILES

CCCCCCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)N(C)CC3=CC=CC=C3)Br

InChI

InChI=1S/C28H32BrN3O4S2/c1-3-4-5-9-18-36-26-17-12-22(19-25(26)29)27(33)31-28(37)30-23-13-15-24(16-14-23)38(34,35)32(2)20-21-10-7-6-8-11-21/h6-8,10-17,19H,3-5,9,18,20H2,1-2H3,(H2,30,31,33,37)