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

Systemtic Name: 3-bromanyl-N-[(3-cyano-4,5-dimethyl-thiophen-2-yl)carbamothioyl]-4-methoxy-benzamide Openeye Name: 3-bromo-N-[(3-cyano-4,5-dimethyl-2-thienyl)carbamothioyl]-4-methoxy-benzamide CAS Name: 3-bromo-N-[[(3-cyano-4,5-dimethyl-2-thiophenyl)amino]-sulfanylidenemethyl]-4-methoxybenzamide IUPAC Name: 3-bromo-N-[(3-cyano-4,5-dimethylthiophen-2-yl)carbamothioyl]-4-methoxybenzamide Traditional Name: 3-bromo-N-[(3-cyano-4,5-dimethyl-2-thienyl)thiocarbamoyl]-4-methoxy-benzamide Formula: C16H14BrN3O2S2 MolecularWeight: 424.33526

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C#N)NC(=S)NC(=O)C2=CC(=C(C=C2)OC)Br)C

Isomeric SMILES

CC1=C(SC(=C1C#N)NC(=S)NC(=O)C2=CC(=C(C=C2)OC)Br)C

InChI

InChI=1S/C16H14BrN3O2S2/c1-8-9(2)24-15(11(8)7-18)20-16(23)19-14(21)10-4-5-13(22-3)12(17)6-10/h4-6H,1-3H3,(H2,19,20,21,23)