N-[[3-[5-(hydroxymethyl)furan-2-yl]phenyl]carbamothioyl]-2-nitro-benzamide

Systemtic Name: N-[[3-[5-(hydroxymethyl)furan-2-yl]phenyl]carbamothioyl]-2-nitro-benzamide Openeye Name: N-[[3-[5-(hydroxymethyl)-2-furyl]phenyl]carbamothioyl]-2-nitro-benzamide CAS Name: N-[[3-[5-(hydroxymethyl)-2-furanyl]anilino]-sulfanylidenemethyl]-2-nitrobenzamide IUPAC Name: N-[[3-[5-(hydroxymethyl)furan-2-yl]phenyl]carbamothioyl]-2-nitrobenzamide Traditional Name: N-[[3-(5-methylol-2-furyl)phenyl]thiocarbamoyl]-2-nitro-benzamide Formula: C19H15N3O5S MolecularWeight: 397.4045

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NC(=S)NC2=CC=CC(=C2)C3=CC=C(O3)CO)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NC(=S)NC2=CC=CC(=C2)C3=CC=C(O3)CO)[N+](=O)[O-]

InChI

InChI=1S/C19H15N3O5S/c23-11-14-8-9-17(27-14)12-4-3-5-13(10-12)20-19(28)21-18(24)15-6-1-2-7-16(15)22(25)26/h1-10,23H,11H2,(H2,20,21,24,28)