3-methyl-N-[3-(6-methylsulfonylpyridazin-3-yl)phenyl]-4-nitro-benzamide

Systemtic Name: 3-methyl-N-[3-(6-methylsulfonylpyridazin-3-yl)phenyl]-4-nitro-benzamide Openeye Name: 3-methyl-N-[3-(6-methylsulfonylpyridazin-3-yl)phenyl]-4-nitro-benzamide CAS Name: 3-methyl-N-[3-(6-methylsulfonyl-3-pyridazinyl)phenyl]-4-nitrobenzamide IUPAC Name: 3-methyl-N-[3-(6-methylsulfonylpyridazin-3-yl)phenyl]-4-nitrobenzamide Traditional Name: N-[3-(6-mesylpyridazin-3-yl)phenyl]-3-methyl-4-nitro-benzamide Formula: C19H16N4O5S MolecularWeight: 412.41914

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)NC2=CC=CC(=C2)C3=NN=C(C=C3)S(=O)(=O)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)NC2=CC=CC(=C2)C3=NN=C(C=C3)S(=O)(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C19H16N4O5S/c1-12-10-14(6-8-17(12)23(25)26)19(24)20-15-5-3-4-13(11-15)16-7-9-18(22-21-16)29(2,27)28/h3-11H,1-2H3,(H,20,24)