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

Systemtic Name: 3-bromanyl-N-[[4-[methyl-(phenylmethyl)sulfamoyl]phenyl]carbamothioyl]-4-propoxy-benzamide Openeye Name: N-[[4-[benzyl(methyl)sulfamoyl]phenyl]carbamothioyl]-3-bromo-4-propoxy-benzamide CAS Name: 3-bromo-N-[[4-[methyl-(phenylmethyl)sulfamoyl]anilino]-sulfanylidenemethyl]-4-propoxybenzamide IUPAC Name: N-[[4-[benzyl(methyl)sulfamoyl]phenyl]carbamothioyl]-3-bromo-4-propoxybenzamide Traditional Name: N-[[4-[benzyl(methyl)sulfamoyl]phenyl]thiocarbamoyl]-3-bromo-4-propoxy-benzamide Formula: C25H26BrN3O4S2 MolecularWeight: 576.52564

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=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

CCCOC1=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/C25H26BrN3O4S2/c1-3-15-33-23-14-9-19(16-22(23)26)24(30)28-25(34)27-20-10-12-21(13-11-20)35(31,32)29(2)17-18-7-5-4-6-8-18/h4-14,16H,3,15,17H2,1-2H3,(H2,27,28,30,34)