3,4-bis(chloranyl)-N-[[1-(2-diethylaminoethylamino)-9-oxidanylidene-thioxanthen-4-yl]methyl]benzenesulfonamide

Systemtic Name: 3,4-bis(chloranyl)-N-[[1-(2-diethylaminoethylamino)-9-oxidanylidene-thioxanthen-4-yl]methyl]benzenesulfonamide Openeye Name: 3,4-dichloro-N-[[1-(2-diethylaminoethylamino)-9-oxo-thioxanthen-4-yl]methyl]benzenesulfonamide CAS Name: 3,4-dichloro-N-[[1-(2-diethylaminoethylamino)-9-oxo-4-thioxanthenyl]methyl]benzenesulfonamide IUPAC Name: 3,4-dichloro-N-[[1-(2-diethylaminoethylamino)-9-oxothioxanthen-4-yl]methyl]benzenesulfonamide Traditional Name: 3,4-dichloro-N-[[1-(2-diethylaminoethylamino)-9-keto-thioxanthen-4-yl]methyl]benzenesulfonamide Formula: C26H27Cl2N3O3S2 MolecularWeight: 564.54688

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCNC1=C2C(=C(C=C1)CNS(=O)(=O)C3=CC(=C(C=C3)Cl)Cl)SC4=CC=CC=C4C2=O

Isomeric SMILES

CCN(CC)CCNC1=C2C(=C(C=C1)CNS(=O)(=O)C3=CC(=C(C=C3)Cl)Cl)SC4=CC=CC=C4C2=O

InChI

InChI=1S/C26H27Cl2N3O3S2/c1-3-31(4-2)14-13-29-22-12-9-17(16-30-36(33,34)18-10-11-20(27)21(28)15-18)26-24(22)25(32)19-7-5-6-8-23(19)35-26/h5-12,15,29-30H,3-4,13-14,16H2,1-2H3