3-nitro-4-[2-[(3-nitrophenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-benzamide

Systemtic Name: 3-nitro-4-[2-[(3-nitrophenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-benzamide Openeye Name: 3-nitro-4-[2-(3-nitroanilino)-2-oxo-ethyl]sulfanyl-benzamide CAS Name: 3-nitro-4-[[2-(3-nitroanilino)-2-oxoethyl]thio]benzamide IUPAC Name: 3-nitro-4-[2-(3-nitroanilino)-2-oxoethyl]sulfanylbenzamide Traditional Name: 4-[[2-keto-2-(3-nitroanilino)ethyl]thio]-3-nitro-benzamide Formula: C15H12N4O6S MolecularWeight: 376.34398

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])NC(=O)CSC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])NC(=O)CSC2=C(C=C(C=C2)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C15H12N4O6S/c16-15(21)9-4-5-13(12(6-9)19(24)25)26-8-14(20)17-10-2-1-3-11(7-10)18(22)23/h1-7H,8H2,(H2,16,21)(H,17,20)