3-bromanyl-4-(2-methoxyethoxy)-N-[(4-morpholin-4-ylsulfonylphenyl)carbamothioyl]benzamide

Systemtic Name: 3-bromanyl-4-(2-methoxyethoxy)-N-[(4-morpholin-4-ylsulfonylphenyl)carbamothioyl]benzamide Openeye Name: 3-bromo-4-(2-methoxyethoxy)-N-[(4-morpholinosulfonylphenyl)carbamothioyl]benzamide CAS Name: 3-bromo-4-(2-methoxyethoxy)-N-[[4-(4-morpholinylsulfonyl)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 3-bromo-4-(2-methoxyethoxy)-N-[(4-morpholin-4-ylsulfonylphenyl)carbamothioyl]benzamide Traditional Name: 3-bromo-4-(2-methoxyethoxy)-N-[(4-morpholinosulfonylphenyl)thiocarbamoyl]benzamide Formula: C21H24BrN3O6S2 MolecularWeight: 558.46576

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3)Br

Isomeric SMILES

COCCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3)Br

InChI

InChI=1S/C21H24BrN3O6S2/c1-29-12-13-31-19-7-2-15(14-18(19)22)20(26)24-21(32)23-16-3-5-17(6-4-16)33(27,28)25-8-10-30-11-9-25/h2-7,14H,8-13H2,1H3,(H2,23,24,26,32)