3-bromanyl-N-[(2,5-dimethoxyphenyl)carbamothioyl]benzamide

Systemtic Name: 3-bromanyl-N-[(2,5-dimethoxyphenyl)carbamothioyl]benzamide Openeye Name: 3-bromo-N-[(2,5-dimethoxyphenyl)carbamothioyl]benzamide CAS Name: 3-bromo-N-[(2,5-dimethoxyanilino)-sulfanylidenemethyl]benzamide IUPAC Name: 3-bromo-N-[(2,5-dimethoxyphenyl)carbamothioyl]benzamide Traditional Name: 3-bromo-N-[(2,5-dimethoxyphenyl)thiocarbamoyl]benzamide Formula: C16H15BrN2O3S MolecularWeight: 395.2709

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H15BrN2O3S/c1-21-12-6-7-14(22-2)13(9-12)18-16(23)19-15(20)10-4-3-5-11(17)8-10/h3-9H,1-2H3,(H2,18,19,20,23)