N-[3-(6-methylsulfonylpyridazin-3-yl)phenyl]-4-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[3-(6-methylsulfonylpyridazin-3-yl)phenyl]-4-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-[3-(6-methylsulfonylpyridazin-3-yl)phenyl]-4-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-[3-(6-methylsulfonyl-3-pyridazinyl)phenyl]-4-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-[3-(6-methylsulfonylpyridazin-3-yl)phenyl]-4-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-[3-(6-mesylpyridazin-3-yl)phenyl]-4-pyrrolidinosulfonyl-benzamide Formula: C22H22N4O5S2 MolecularWeight: 486.56388

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=NN=C(C=C1)C2=CC(=CC=C2)NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCC4

Isomeric SMILES

CS(=O)(=O)C1=NN=C(C=C1)C2=CC(=CC=C2)NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C22H22N4O5S2/c1-32(28,29)21-12-11-20(24-25-21)17-5-4-6-18(15-17)23-22(27)16-7-9-19(10-8-16)33(30,31)26-13-2-3-14-26/h4-12,15H,2-3,13-14H2,1H3,(H,23,27)