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

Systemtic Name: 4-butoxy-N-[3-(6-methylsulfonylpyridazin-3-yl)phenyl]benzamide Openeye Name: 4-butoxy-N-[3-(6-methylsulfonylpyridazin-3-yl)phenyl]benzamide CAS Name: 4-butoxy-N-[3-(6-methylsulfonyl-3-pyridazinyl)phenyl]benzamide IUPAC Name: 4-butoxy-N-[3-(6-methylsulfonylpyridazin-3-yl)phenyl]benzamide Traditional Name: 4-butoxy-N-[3-(6-mesylpyridazin-3-yl)phenyl]benzamide Formula: C22H23N3O4S MolecularWeight: 425.50072

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)NC2=CC=CC(=C2)C3=NN=C(C=C3)S(=O)(=O)C

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)NC2=CC=CC(=C2)C3=NN=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C22H23N3O4S/c1-3-4-14-29-19-10-8-16(9-11-19)22(26)23-18-7-5-6-17(15-18)20-12-13-21(25-24-20)30(2,27)28/h5-13,15H,3-4,14H2,1-2H3,(H,23,26)