N-[2-[(pyridin-3-ylmethylamino)methyl]-3,4-dihydro-2H-chromen-7-yl]benzenesulfonamide

Systemtic Name: N-[2-[(pyridin-3-ylmethylamino)methyl]-3,4-dihydro-2H-chromen-7-yl]benzenesulfonamide Openeye Name: N-[2-[(3-pyridylmethylamino)methyl]chroman-7-yl]benzenesulfonamide CAS Name: N-[2-[(3-pyridinylmethylamino)methyl]-3,4-dihydro-2H-1-benzopyran-7-yl]benzenesulfonamide IUPAC Name: N-[2-[(pyridin-3-ylmethylamino)methyl]-3,4-dihydro-2H-chromen-7-yl]benzenesulfonamide Traditional Name: N-[2-[(3-pyridylmethylamino)methyl]chroman-7-yl]benzenesulfonamide Formula: C22H23N3O3S MolecularWeight: 409.50132

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=C(C=C2)NS(=O)(=O)C3=CC=CC=C3)OC1CNCC4=CN=CC=C4

Isomeric SMILES

C1CC2=C(C=C(C=C2)NS(=O)(=O)C3=CC=CC=C3)OC1CNCC4=CN=CC=C4

InChI

InChI=1S/C22H23N3O3S/c26-29(27,21-6-2-1-3-7-21)25-19-10-8-18-9-11-20(28-22(18)13-19)16-24-15-17-5-4-12-23-14-17/h1-8,10,12-14,20,24-25H,9,11,15-16H2