N-[3-[6-(azepan-1-yl)pyridazin-3-yl]phenyl]-5-ethyl-thiophene-2-sulfonamide

Systemtic Name: N-[3-[6-(azepan-1-yl)pyridazin-3-yl]phenyl]-5-ethyl-thiophene-2-sulfonamide Openeye Name: N-[3-[6-(azepan-1-yl)pyridazin-3-yl]phenyl]-5-ethyl-thiophene-2-sulfonamide CAS Name: N-[3-[6-(1-azepanyl)-3-pyridazinyl]phenyl]-5-ethyl-2-thiophenesulfonamide IUPAC Name: N-[3-[6-(azepan-1-yl)pyridazin-3-yl]phenyl]-5-ethylthiophene-2-sulfonamide Traditional Name: N-[3-[6-(azepan-1-yl)pyridazin-3-yl]phenyl]-5-ethyl-thiophene-2-sulfonamide Formula: C22H26N4O2S2 MolecularWeight: 442.59744

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(S1)S(=O)(=O)NC2=CC=CC(=C2)C3=NN=C(C=C3)N4CCCCCC4

Isomeric SMILES

CCC1=CC=C(S1)S(=O)(=O)NC2=CC=CC(=C2)C3=NN=C(C=C3)N4CCCCCC4

InChI

InChI=1S/C22H26N4O2S2/c1-2-19-10-13-22(29-19)30(27,28)25-18-9-7-8-17(16-18)20-11-12-21(24-23-20)26-14-5-3-4-6-15-26/h7-13,16,25H,2-6,14-15H2,1H3