N-[(3-hydroxyphenyl)carbamothioyl]-3-nitro-benzamide

Systemtic Name: N-[(3-hydroxyphenyl)carbamothioyl]-3-nitro-benzamide Openeye Name: N-[(3-hydroxyphenyl)carbamothioyl]-3-nitro-benzamide CAS Name: N-[(3-hydroxyanilino)-sulfanylidenemethyl]-3-nitrobenzamide IUPAC Name: N-[(3-hydroxyphenyl)carbamothioyl]-3-nitrobenzamide Traditional Name: N-[(3-hydroxyphenyl)thiocarbamoyl]-3-nitro-benzamide Formula: C14H11N3O4S MolecularWeight: 317.31984

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H11N3O4S/c18-12-6-2-4-10(8-12)15-14(22)16-13(19)9-3-1-5-11(7-9)17(20)21/h1-8,18H,(H2,15,16,19,22)