N-[4-[6-(azepan-1-yl)pyridazin-3-yl]phenyl]pyridine-3-sulfonamide

Systemtic Name: N-[4-[6-(azepan-1-yl)pyridazin-3-yl]phenyl]pyridine-3-sulfonamide Openeye Name: N-[4-[6-(azepan-1-yl)pyridazin-3-yl]phenyl]pyridine-3-sulfonamide CAS Name: N-[4-[6-(1-azepanyl)-3-pyridazinyl]phenyl]-3-pyridinesulfonamide IUPAC Name: N-[4-[6-(azepan-1-yl)pyridazin-3-yl]phenyl]pyridine-3-sulfonamide Traditional Name: N-[4-[6-(azepan-1-yl)pyridazin-3-yl]phenyl]pyridine-3-sulfonamide Formula: C21H23N5O2S MolecularWeight: 409.50462

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=NN=C(C=C2)C3=CC=C(C=C3)NS(=O)(=O)C4=CN=CC=C4

Isomeric SMILES

C1CCCN(CC1)C2=NN=C(C=C2)C3=CC=C(C=C3)NS(=O)(=O)C4=CN=CC=C4

InChI

InChI=1S/C21H23N5O2S/c27-29(28,19-6-5-13-22-16-19)25-18-9-7-17(8-10-18)20-11-12-21(24-23-20)26-14-3-1-2-4-15-26/h5-13,16,25H,1-4,14-15H2