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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)Br)C(=O)NC(=S)NC2=C(C(=C(S2)C)C)C#N)OC

Isomeric SMILES

CC1=C(C(=CC(=C1)Br)C(=O)NC(=S)NC2=C(C(=C(S2)C)C)C#N)OC

InChI

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