3-bromanyl-N-[(3-cyano-4,5-dimethyl-thiophen-2-yl)carbamothioyl]-4-ethoxy-benzamide

Systemtic Name: 3-bromanyl-N-[(3-cyano-4,5-dimethyl-thiophen-2-yl)carbamothioyl]-4-ethoxy-benzamide Openeye Name: 3-bromo-N-[(3-cyano-4,5-dimethyl-2-thienyl)carbamothioyl]-4-ethoxy-benzamide CAS Name: 3-bromo-N-[[(3-cyano-4,5-dimethyl-2-thiophenyl)amino]-sulfanylidenemethyl]-4-ethoxybenzamide IUPAC Name: 3-bromo-N-[(3-cyano-4,5-dimethylthiophen-2-yl)carbamothioyl]-4-ethoxybenzamide Traditional Name: 3-bromo-N-[(3-cyano-4,5-dimethyl-2-thienyl)thiocarbamoyl]-4-ethoxy-benzamide Formula: C17H16BrN3O2S2 MolecularWeight: 438.36184

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=C(C(=C(S2)C)C)C#N)Br

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=C(C(=C(S2)C)C)C#N)Br

InChI

InChI=1S/C17H16BrN3O2S2/c1-4-23-14-6-5-11(7-13(14)18)15(22)20-17(24)21-16-12(8-19)9(2)10(3)25-16/h5-7H,4H2,1-3H3,(H2,20,21,22,24)