N-[2-[(4-methylsulfonyl-2-nitro-phenyl)amino]ethyl]-6-oxidanylidene-1-propyl-pyridazine-3-carboxamide

Systemtic Name: N-[2-[(4-methylsulfonyl-2-nitro-phenyl)amino]ethyl]-6-oxidanylidene-1-propyl-pyridazine-3-carboxamide Openeye Name: N-[2-(4-methylsulfonyl-2-nitro-anilino)ethyl]-6-oxo-1-propyl-pyridazine-3-carboxamide CAS Name: N-[2-(4-methylsulfonyl-2-nitroanilino)ethyl]-6-oxo-1-propyl-3-pyridazinecarboxamide IUPAC Name: N-[2-(4-methylsulfonyl-2-nitroanilino)ethyl]-6-oxo-1-propylpyridazine-3-carboxamide Traditional Name: 6-keto-N-[2-(4-mesyl-2-nitro-anilino)ethyl]-1-propyl-pyridazine-3-carboxamide Formula: C17H21N5O6S MolecularWeight: 423.44354

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C=CC(=N1)C(=O)NCCNC2=C(C=C(C=C2)S(=O)(=O)C)[N+](=O)[O-]

Isomeric SMILES

CCCN1C(=O)C=CC(=N1)C(=O)NCCNC2=C(C=C(C=C2)S(=O)(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C17H21N5O6S/c1-3-10-21-16(23)7-6-14(20-21)17(24)19-9-8-18-13-5-4-12(29(2,27)28)11-15(13)22(25)26/h4-7,11,18H,3,8-10H2,1-2H3,(H,19,24)