N-[[5-[(4-bromophenyl)sulfamoyl]-2-methoxy-phenyl]carbamothioyl]cyclopropanecarboxamide

Systemtic Name: N-[[5-[(4-bromophenyl)sulfamoyl]-2-methoxy-phenyl]carbamothioyl]cyclopropanecarboxamide Openeye Name: N-[[5-[(4-bromophenyl)sulfamoyl]-2-methoxy-phenyl]carbamothioyl]cyclopropanecarboxamide CAS Name: N-[[5-[(4-bromophenyl)sulfamoyl]-2-methoxyanilino]-sulfanylidenemethyl]cyclopropanecarboxamide IUPAC Name: N-[[5-[(4-bromophenyl)sulfamoyl]-2-methoxyphenyl]carbamothioyl]cyclopropanecarboxamide Traditional Name: N-[[5-[(4-bromophenyl)sulfamoyl]-2-methoxy-phenyl]thiocarbamoyl]cyclopropanecarboxamide Formula: C18H18BrN3O4S2 MolecularWeight: 484.38722

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)Br)NC(=S)NC(=O)C3CC3

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)Br)NC(=S)NC(=O)C3CC3

InChI

InChI=1S/C18H18BrN3O4S2/c1-26-16-9-8-14(28(24,25)22-13-6-4-12(19)5-7-13)10-15(16)20-18(27)21-17(23)11-2-3-11/h4-11,22H,2-3H2,1H3,(H2,20,21,23,27)