N-[3-(6-propoxypyridazin-3-yl)phenyl]-3,5-bis(trifluoromethyl)benzenesulfonamide

Systemtic Name: N-[3-(6-propoxypyridazin-3-yl)phenyl]-3,5-bis(trifluoromethyl)benzenesulfonamide Openeye Name: N-[3-(6-propoxypyridazin-3-yl)phenyl]-3,5-bis(trifluoromethyl)benzenesulfonamide CAS Name: N-[3-(6-propoxy-3-pyridazinyl)phenyl]-3,5-bis(trifluoromethyl)benzenesulfonamide IUPAC Name: N-[3-(6-propoxypyridazin-3-yl)phenyl]-3,5-bis(trifluoromethyl)benzenesulfonamide Traditional Name: N-[3-(6-propoxypyridazin-3-yl)phenyl]-3,5-bis(trifluoromethyl)benzenesulfonamide Formula: C21H17F6N3O3S MolecularWeight: 505.433399

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=NN=C(C=C1)C2=CC(=CC=C2)NS(=O)(=O)C3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F

Isomeric SMILES

CCCOC1=NN=C(C=C1)C2=CC(=CC=C2)NS(=O)(=O)C3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C21H17F6N3O3S/c1-2-8-33-19-7-6-18(28-29-19)13-4-3-5-16(9-13)30-34(31,32)17-11-14(20(22,23)24)10-15(12-17)21(25,26)27/h3-7,9-12,30H,2,8H2,1H3