N-[(3-benzamidophenyl)carbamothioyl]-5-bromanyl-2-methoxy-benzamide

Systemtic Name: N-[(3-benzamidophenyl)carbamothioyl]-5-bromanyl-2-methoxy-benzamide Openeye Name: N-[(3-benzamidophenyl)carbamothioyl]-5-bromo-2-methoxy-benzamide CAS Name: N-[(3-benzamidoanilino)-sulfanylidenemethyl]-5-bromo-2-methoxybenzamide IUPAC Name: N-[(3-benzamidophenyl)carbamothioyl]-5-bromo-2-methoxybenzamide Traditional Name: N-[(3-benzamidophenyl)thiocarbamoyl]-5-bromo-2-methoxy-benzamide Formula: C22H18BrN3O3S MolecularWeight: 484.36562

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)C(=O)NC(=S)NC2=CC=CC(=C2)NC(=O)C3=CC=CC=C3

Isomeric SMILES

COC1=C(C=C(C=C1)Br)C(=O)NC(=S)NC2=CC=CC(=C2)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H18BrN3O3S/c1-29-19-11-10-15(23)12-18(19)21(28)26-22(30)25-17-9-5-8-16(13-17)24-20(27)14-6-3-2-4-7-14/h2-13H,1H3,(H,24,27)(H2,25,26,28,30)