N-[2-[(5-methoxy-3,4-dihydro-2H-thiochromen-3-yl)-propyl-amino]ethyl]-4-methyl-benzenesulfonamide

Systemtic Name: N-[2-[(5-methoxy-3,4-dihydro-2H-thiochromen-3-yl)-propyl-amino]ethyl]-4-methyl-benzenesulfonamide Openeye Name: N-[2-[(5-methoxythiochroman-3-yl)-propyl-amino]ethyl]-4-methyl-benzenesulfonamide CAS Name: N-[2-[(5-methoxy-3,4-dihydro-2H-1-benzothiopyran-3-yl)-propylamino]ethyl]-4-methylbenzenesulfonamide IUPAC Name: N-[2-[(5-methoxy-3,4-dihydro-2H-thiochromen-3-yl)-propylamino]ethyl]-4-methylbenzenesulfonamide Traditional Name: N-[2-[(5-methoxythiochroman-3-yl)-propyl-amino]ethyl]-4-methyl-benzenesulfonamide Formula: C22H30N2O3S2 MolecularWeight: 434.6152

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCNS(=O)(=O)C1=CC=C(C=C1)C)C2CC3=C(C=CC=C3SC2)OC

Isomeric SMILES

CCCN(CCNS(=O)(=O)C1=CC=C(C=C1)C)C2CC3=C(C=CC=C3SC2)OC

InChI

InChI=1S/C22H30N2O3S2/c1-4-13-24(14-12-23-29(25,26)19-10-8-17(2)9-11-19)18-15-20-21(27-3)6-5-7-22(20)28-16-18/h5-11,18,23H,4,12-16H2,1-3H3