N-[(3-cyano-4,5-dimethyl-thiophen-2-yl)carbamothioyl]-1-benzofuran-2-carboxamide

Systemtic Name: N-[(3-cyano-4,5-dimethyl-thiophen-2-yl)carbamothioyl]-1-benzofuran-2-carboxamide Openeye Name: N-[(3-cyano-4,5-dimethyl-2-thienyl)carbamothioyl]benzofuran-2-carboxamide CAS Name: N-[[(3-cyano-4,5-dimethyl-2-thiophenyl)amino]-sulfanylidenemethyl]-2-benzofurancarboxamide IUPAC Name: N-[(3-cyano-4,5-dimethylthiophen-2-yl)carbamothioyl]-1-benzofuran-2-carboxamide Traditional Name: N-[(3-cyano-4,5-dimethyl-2-thienyl)thiocarbamoyl]coumarilamide Formula: C17H13N3O2S2 MolecularWeight: 355.43402

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C#N)NC(=S)NC(=O)C2=CC3=CC=CC=C3O2)C

Isomeric SMILES

CC1=C(SC(=C1C#N)NC(=S)NC(=O)C2=CC3=CC=CC=C3O2)C

InChI

InChI=1S/C17H13N3O2S2/c1-9-10(2)24-16(12(9)8-18)20-17(23)19-15(21)14-7-11-5-3-4-6-13(11)22-14/h3-7H,1-2H3,(H2,19,20,21,23)