N-[(3-acetamidophenyl)carbamothioyl]-3-bromanyl-4-methoxy-benzamide

Systemtic Name: N-[(3-acetamidophenyl)carbamothioyl]-3-bromanyl-4-methoxy-benzamide Openeye Name: N-[(3-acetamidophenyl)carbamothioyl]-3-bromo-4-methoxy-benzamide CAS Name: N-[(3-acetamidoanilino)-sulfanylidenemethyl]-3-bromo-4-methoxybenzamide IUPAC Name: N-[(3-acetamidophenyl)carbamothioyl]-3-bromo-4-methoxybenzamide Traditional Name: N-[(3-acetamidophenyl)thiocarbamoyl]-3-bromo-4-methoxy-benzamide Formula: C17H16BrN3O3S MolecularWeight: 422.29624

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=CC=C1)NC(=S)NC(=O)C2=CC(=C(C=C2)OC)Br

Isomeric SMILES

CC(=O)NC1=CC(=CC=C1)NC(=S)NC(=O)C2=CC(=C(C=C2)OC)Br

InChI

InChI=1S/C17H16BrN3O3S/c1-10(22)19-12-4-3-5-13(9-12)20-17(25)21-16(23)11-6-7-15(24-2)14(18)8-11/h3-9H,1-2H3,(H,19,22)(H2,20,21,23,25)