N-[3-[6-(azepan-1-yl)pyridazin-3-yl]phenyl]-4-sulfamoyl-benzamide

Systemtic Name: N-[3-[6-(azepan-1-yl)pyridazin-3-yl]phenyl]-4-sulfamoyl-benzamide Openeye Name: N-[3-[6-(azepan-1-yl)pyridazin-3-yl]phenyl]-4-sulfamoyl-benzamide CAS Name: N-[3-[6-(1-azepanyl)-3-pyridazinyl]phenyl]-4-sulfamoylbenzamide IUPAC Name: N-[3-[6-(azepan-1-yl)pyridazin-3-yl]phenyl]-4-sulfamoylbenzamide Traditional Name: N-[3-[6-(azepan-1-yl)pyridazin-3-yl]phenyl]-4-sulfamoyl-benzamide Formula: C23H25N5O3S MolecularWeight: 451.5413

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=NN=C(C=C2)C3=CC(=CC=C3)NC(=O)C4=CC=C(C=C4)S(=O)(=O)N

Isomeric SMILES

C1CCCN(CC1)C2=NN=C(C=C2)C3=CC(=CC=C3)NC(=O)C4=CC=C(C=C4)S(=O)(=O)N

InChI

InChI=1S/C23H25N5O3S/c24-32(30,31)20-10-8-17(9-11-20)23(29)25-19-7-5-6-18(16-19)21-12-13-22(27-26-21)28-14-3-1-2-4-15-28/h5-13,16H,1-4,14-15H2,(H,25,29)(H2,24,30,31)