2-[3-[1-(3,4-dihydro-2H-thiochromen-8-yloxy)ethylamino]propanoyl]isoindole-1,3-dione

Systemtic Name: 2-[3-[1-(3,4-dihydro-2H-thiochromen-8-yloxy)ethylamino]propanoyl]isoindole-1,3-dione Openeye Name: 2-[3-(1-thiochroman-8-yloxyethylamino)propanoyl]isoindoline-1,3-dione CAS Name: 2-[3-[1-(3,4-dihydro-2H-1-benzothiopyran-8-yloxy)ethylamino]-1-oxopropyl]isoindole-1,3-dione IUPAC Name: 2-[3-[1-(3,4-dihydro-2H-thiochromen-8-yloxy)ethylamino]propanoyl]isoindole-1,3-dione Traditional Name: 2-[3-(1-thiochroman-8-yloxyethylamino)propanoyl]isoindoline-1,3-quinone Formula: C22H22N2O4S MolecularWeight: 410.48608

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Descriptors Computed from Structure

Canonical SMILES:

CC(NCCC(=O)N1C(=O)C2=CC=CC=C2C1=O)OC3=CC=CC4=C3SCCC4

Isomeric SMILES

CC(NCCC(=O)N1C(=O)C2=CC=CC=C2C1=O)OC3=CC=CC4=C3SCCC4

InChI

InChI=1S/C22H22N2O4S/c1-14(28-18-10-4-6-15-7-5-13-29-20(15)18)23-12-11-19(25)24-21(26)16-8-2-3-9-17(16)22(24)27/h2-4,6,8-10,14,23H,5,7,11-13H2,1H3