N-[[4-[5-(hydroxymethyl)furan-2-yl]phenyl]carbamothioyl]-2,1,3-benzothiadiazole-5-carboxamide

Systemtic Name: N-[[4-[5-(hydroxymethyl)furan-2-yl]phenyl]carbamothioyl]-2,1,3-benzothiadiazole-5-carboxamide Openeye Name: N-[[4-[5-(hydroxymethyl)-2-furyl]phenyl]carbamothioyl]-2,1,3-benzothiadiazole-5-carboxamide CAS Name: N-[[4-[5-(hydroxymethyl)-2-furanyl]anilino]-sulfanylidenemethyl]-2,1,3-benzothiadiazole-5-carboxamide IUPAC Name: N-[[4-[5-(hydroxymethyl)furan-2-yl]phenyl]carbamothioyl]-2,1,3-benzothiadiazole-5-carboxamide Traditional Name: N-[[4-(5-methylol-2-furyl)phenyl]thiocarbamoyl]piazthiole-5-carboxamide Formula: C19H14N4O3S2 MolecularWeight: 410.46946

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CC=C(O2)CO)NC(=S)NC(=O)C3=CC4=NSN=C4C=C3

Isomeric SMILES

C1=CC(=CC=C1C2=CC=C(O2)CO)NC(=S)NC(=O)C3=CC4=NSN=C4C=C3

InChI

InChI=1S/C19H14N4O3S2/c24-10-14-6-8-17(26-14)11-1-4-13(5-2-11)20-19(27)21-18(25)12-3-7-15-16(9-12)23-28-22-15/h1-9,24H,10H2,(H2,20,21,25,27)