1-azanyl-1-[2-[1-(diethylamino)ethyl]-7-methoxy-9-oxidanylidene-thioxanthen-4-yl]ethanesulfonamide

Systemtic Name: 1-azanyl-1-[2-[1-(diethylamino)ethyl]-7-methoxy-9-oxidanylidene-thioxanthen-4-yl]ethanesulfonamide Openeye Name: 1-amino-1-[2-[1-(diethylamino)ethyl]-7-methoxy-9-oxo-thioxanthen-4-yl]ethanesulfonamide CAS Name: 1-amino-1-[2-[1-(diethylamino)ethyl]-7-methoxy-9-oxo-4-thioxanthenyl]ethanesulfonamide IUPAC Name: 1-amino-1-[2-[1-(diethylamino)ethyl]-7-methoxy-9-oxothioxanthen-4-yl]ethanesulfonamide Traditional Name: 1-amino-1-[2-[1-(diethylamino)ethyl]-9-keto-7-methoxy-thioxanthen-4-yl]ethanesulfonamide Formula: C22H29N3O4S2 MolecularWeight: 463.61336

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(C)C1=CC(=C2C(=C1)C(=O)C3=C(S2)C=CC(=C3)OC)C(C)(N)S(=O)(=O)N

Isomeric SMILES

CCN(CC)C(C)C1=CC(=C2C(=C1)C(=O)C3=C(S2)C=CC(=C3)OC)C(C)(N)S(=O)(=O)N

InChI

InChI=1S/C22H29N3O4S2/c1-6-25(7-2)13(3)14-10-17-20(26)16-12-15(29-5)8-9-19(16)30-21(17)18(11-14)22(4,23)31(24,27)28/h8-13H,6-7,23H2,1-5H3,(H2,24,27,28)