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

Systemtic Name: 1-(2-methoxyethyl)-N-[2-[(4-methylsulfonyl-2-nitro-phenyl)amino]ethyl]-6-oxidanylidene-pyridazine-3-carboxamide Openeye Name: 1-(2-methoxyethyl)-N-[2-(4-methylsulfonyl-2-nitro-anilino)ethyl]-6-oxo-pyridazine-3-carboxamide CAS Name: 1-(2-methoxyethyl)-N-[2-(4-methylsulfonyl-2-nitroanilino)ethyl]-6-oxo-3-pyridazinecarboxamide IUPAC Name: 1-(2-methoxyethyl)-N-[2-(4-methylsulfonyl-2-nitroanilino)ethyl]-6-oxopyridazine-3-carboxamide Traditional Name: 6-keto-N-[2-(4-mesyl-2-nitro-anilino)ethyl]-1-(2-methoxyethyl)pyridazine-3-carboxamide Formula: C17H21N5O7S MolecularWeight: 439.44294

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C(=O)C=CC(=N1)C(=O)NCCNC2=C(C=C(C=C2)S(=O)(=O)C)[N+](=O)[O-]

Isomeric SMILES

COCCN1C(=O)C=CC(=N1)C(=O)NCCNC2=C(C=C(C=C2)S(=O)(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C17H21N5O7S/c1-29-10-9-21-16(23)6-5-14(20-21)17(24)19-8-7-18-13-4-3-12(30(2,27)28)11-15(13)22(25)26/h3-6,11,18H,7-10H2,1-2H3,(H,19,24)