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

Systemtic Name: 4-tert-butyl-N-[3-(6-methylsulfonylpyridazin-3-yl)phenyl]benzamide Openeye Name: 4-tert-butyl-N-[3-(6-methylsulfonylpyridazin-3-yl)phenyl]benzamide CAS Name: 4-tert-butyl-N-[3-(6-methylsulfonyl-3-pyridazinyl)phenyl]benzamide IUPAC Name: 4-tert-butyl-N-[3-(6-methylsulfonylpyridazin-3-yl)phenyl]benzamide Traditional Name: 4-tert-butyl-N-[3-(6-mesylpyridazin-3-yl)phenyl]benzamide Formula: C22H23N3O3S MolecularWeight: 409.50132

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H23N3O3S/c1-22(2,3)17-10-8-15(9-11-17)21(26)23-18-7-5-6-16(14-18)19-12-13-20(25-24-19)29(4,27)28/h5-14H,1-4H3,(H,23,26)