5-chloranyl-2-nitro-N-[2-(6-oxidanylidene-3-thiophen-2-yl-pyridazin-1-yl)ethyl]benzamide

Systemtic Name: 5-chloranyl-2-nitro-N-[2-(6-oxidanylidene-3-thiophen-2-yl-pyridazin-1-yl)ethyl]benzamide Openeye Name: 5-chloro-2-nitro-N-[2-[6-oxo-3-(2-thienyl)pyridazin-1-yl]ethyl]benzamide CAS Name: 5-chloro-2-nitro-N-[2-(6-oxo-3-thiophen-2-yl-1-pyridazinyl)ethyl]benzamide IUPAC Name: 5-chloro-2-nitro-N-[2-(6-oxo-3-thiophen-2-ylpyridazin-1-yl)ethyl]benzamide Traditional Name: 5-chloro-N-[2-[6-keto-3-(2-thienyl)pyridazin-1-yl]ethyl]-2-nitro-benzamide Formula: C17H13ClN4O4S MolecularWeight: 404.82752

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C2=NN(C(=O)C=C2)CCNC(=O)C3=C(C=CC(=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CSC(=C1)C2=NN(C(=O)C=C2)CCNC(=O)C3=C(C=CC(=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C17H13ClN4O4S/c18-11-3-5-14(22(25)26)12(10-11)17(24)19-7-8-21-16(23)6-4-13(20-21)15-2-1-9-27-15/h1-6,9-10H,7-8H2,(H,19,24)