N-[(4-acetamidophenyl)carbamothioyl]-5-bromanyl-2-methoxy-benzamide

Systemtic Name: N-[(4-acetamidophenyl)carbamothioyl]-5-bromanyl-2-methoxy-benzamide Openeye Name: N-[(4-acetamidophenyl)carbamothioyl]-5-bromo-2-methoxy-benzamide CAS Name: N-[(4-acetamidoanilino)-sulfanylidenemethyl]-5-bromo-2-methoxybenzamide IUPAC Name: N-[(4-acetamidophenyl)carbamothioyl]-5-bromo-2-methoxybenzamide Traditional Name: N-[(4-acetamidophenyl)thiocarbamoyl]-5-bromo-2-methoxy-benzamide Formula: C17H16BrN3O3S MolecularWeight: 422.29624

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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