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

Systemtic Name: 3-bromanyl-N-[(3-cyanophenyl)carbamothioyl]-4-methoxy-benzamide Openeye Name: 3-bromo-N-[(3-cyanophenyl)carbamothioyl]-4-methoxy-benzamide CAS Name: 3-bromo-N-[(3-cyanoanilino)-sulfanylidenemethyl]-4-methoxybenzamide IUPAC Name: 3-bromo-N-[(3-cyanophenyl)carbamothioyl]-4-methoxybenzamide Traditional Name: 3-bromo-N-[(3-cyanophenyl)thiocarbamoyl]-4-methoxy-benzamide Formula: C16H12BrN3O2S MolecularWeight: 390.25438

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H12BrN3O2S/c1-22-14-6-5-11(8-13(14)17)15(21)20-16(23)19-12-4-2-3-10(7-12)9-18/h2-8H,1H3,(H2,19,20,21,23)