N-[[4-(1-benzofuran-2-yl)-1,3-thiazol-2-yl]carbamothioyl]-4-ethoxy-benzamide

Systemtic Name: N-[[4-(1-benzofuran-2-yl)-1,3-thiazol-2-yl]carbamothioyl]-4-ethoxy-benzamide Openeye Name: N-[[4-(benzofuran-2-yl)thiazol-2-yl]carbamothioyl]-4-ethoxy-benzamide CAS Name: N-[[[4-(2-benzofuranyl)-2-thiazolyl]amino]-sulfanylidenemethyl]-4-ethoxybenzamide IUPAC Name: N-[[4-(1-benzofuran-2-yl)-1,3-thiazol-2-yl]carbamothioyl]-4-ethoxybenzamide Traditional Name: N-[[4-(benzofuran-2-yl)thiazol-2-yl]thiocarbamoyl]-4-ethoxy-benzamide Formula: C21H17N3O3S2 MolecularWeight: 423.50798

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=NC(=CS2)C3=CC4=CC=CC=C4O3

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=NC(=CS2)C3=CC4=CC=CC=C4O3

InChI

InChI=1S/C21H17N3O3S2/c1-2-26-15-9-7-13(8-10-15)19(25)23-20(28)24-21-22-16(12-29-21)18-11-14-5-3-4-6-17(14)27-18/h3-12H,2H2,1H3,(H2,22,23,24,25,28)