4-bromanyl-N-[[4-(ethanoylsulfamoyl)phenyl]carbamothioyl]-3-methoxy-naphthalene-2-carboxamide

Systemtic Name: 4-bromanyl-N-[[4-(ethanoylsulfamoyl)phenyl]carbamothioyl]-3-methoxy-naphthalene-2-carboxamide Openeye Name: N-[[4-(acetylsulfamoyl)phenyl]carbamothioyl]-4-bromo-3-methoxy-naphthalene-2-carboxamide CAS Name: N-[[4-(acetylsulfamoyl)anilino]-sulfanylidenemethyl]-4-bromo-3-methoxy-2-naphthalenecarboxamide IUPAC Name: N-[[4-(acetylsulfamoyl)phenyl]carbamothioyl]-4-bromo-3-methoxynaphthalene-2-carboxamide Traditional Name: N-[[4-(acetylsulfamoyl)phenyl]thiocarbamoyl]-4-bromo-3-methoxy-2-naphthamide Formula: C21H18BrN3O5S2 MolecularWeight: 536.41872

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NS(=O)(=O)C1=CC=C(C=C1)NC(=S)NC(=O)C2=CC3=CC=CC=C3C(=C2OC)Br

Isomeric SMILES

CC(=O)NS(=O)(=O)C1=CC=C(C=C1)NC(=S)NC(=O)C2=CC3=CC=CC=C3C(=C2OC)Br

InChI

InChI=1S/C21H18BrN3O5S2/c1-12(26)25-32(28,29)15-9-7-14(8-10-15)23-21(31)24-20(27)17-11-13-5-3-4-6-16(13)18(22)19(17)30-2/h3-11H,1-2H3,(H,25,26)(H2,23,24,27,31)