N-(2,5-dimethoxy-4-nitro-phenyl)benzenecarbothioamide

Systemtic Name: N-(2,5-dimethoxy-4-nitro-phenyl)benzenecarbothioamide Openeye Name: N-(2,5-dimethoxy-4-nitro-phenyl)benzenecarbothioamide CAS Name: N-(2,5-dimethoxy-4-nitrophenyl)benzenecarbothioamide IUPAC Name: N-(2,5-dimethoxy-4-nitrophenyl)benzenecarbothioamide Traditional Name: N-(2,5-dimethoxy-4-nitro-phenyl)thiobenzamide Formula: C15H14N2O4S MolecularWeight: 318.34766

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NC(=S)C2=CC=CC=C2)OC)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=C(C=C1NC(=S)C2=CC=CC=C2)OC)[N+](=O)[O-]

InChI

InChI=1S/C15H14N2O4S/c1-20-13-9-12(17(18)19)14(21-2)8-11(13)16-15(22)10-6-4-3-5-7-10/h3-9H,1-2H3,(H,16,22)