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

Systemtic Name: 1-azanyl-1-[2-[1-(diethylamino)ethyl]-7-oxidanyl-9-oxidanylidene-thioxanthen-4-yl]ethanesulfonamide Openeye Name: 1-amino-1-[2-[1-(diethylamino)ethyl]-7-hydroxy-9-oxo-thioxanthen-4-yl]ethanesulfonamide CAS Name: 1-amino-1-[2-[1-(diethylamino)ethyl]-7-hydroxy-9-oxo-4-thioxanthenyl]ethanesulfonamide IUPAC Name: 1-amino-1-[2-[1-(diethylamino)ethyl]-7-hydroxy-9-oxothioxanthen-4-yl]ethanesulfonamide Traditional Name: 1-amino-1-[2-[1-(diethylamino)ethyl]-7-hydroxy-9-keto-thioxanthen-4-yl]ethanesulfonamide Formula: C21H27N3O4S2 MolecularWeight: 449.58678

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Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C21H27N3O4S2/c1-5-24(6-2)12(3)13-9-16-19(26)15-11-14(25)7-8-18(15)29-20(16)17(10-13)21(4,22)30(23,27)28/h7-12,25H,5-6,22H2,1-4H3,(H2,23,27,28)