N-[3-[5-(1,3-benzodioxol-5-ylmethylamino)pyridin-3-yl]phenyl]methanesulfonamide

Systemtic Name: N-[3-[5-(1,3-benzodioxol-5-ylmethylamino)pyridin-3-yl]phenyl]methanesulfonamide Openeye Name: N-[3-[5-(1,3-benzodioxol-5-ylmethylamino)-3-pyridyl]phenyl]methanesulfonamide CAS Name: N-[3-[5-(1,3-benzodioxol-5-ylmethylamino)-3-pyridinyl]phenyl]methanesulfonamide IUPAC Name: N-[3-[5-(1,3-benzodioxol-5-ylmethylamino)pyridin-3-yl]phenyl]methanesulfonamide Traditional Name: N-[3-[5-(piperonylamino)-3-pyridyl]phenyl]methanesulfonamide Formula: C20H19N3O4S MolecularWeight: 397.44756

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC1=CC=CC(=C1)C2=CC(=CN=C2)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CS(=O)(=O)NC1=CC=CC(=C1)C2=CC(=CN=C2)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H19N3O4S/c1-28(24,25)23-17-4-2-3-15(8-17)16-9-18(12-21-11-16)22-10-14-5-6-19-20(7-14)27-13-26-19/h2-9,11-12,22-23H,10,13H2,1H3