1-[[1-(2-diethylaminoethylamino)-9-oxidanylidene-thioxanthen-4-yl]methyl-methyl-sulfamoyl]ethyl methanesulfonate

Systemtic Name: 1-[[1-(2-diethylaminoethylamino)-9-oxidanylidene-thioxanthen-4-yl]methyl-methyl-sulfamoyl]ethyl methanesulfonate Openeye Name: 1-[[1-(2-diethylaminoethylamino)-9-oxo-thioxanthen-4-yl]methyl-methyl-sulfamoyl]ethyl methanesulfonate CAS Name: methanesulfonic acid 1-[[1-(2-diethylaminoethylamino)-9-oxo-4-thioxanthenyl]methyl-methylsulfamoyl]ethyl ester IUPAC Name: 1-[[1-(2-diethylaminoethylamino)-9-oxothioxanthen-4-yl]methyl-methylsulfamoyl]ethyl methanesulfonate Traditional Name: methanesulfonic acid 1-[[1-(2-diethylaminoethylamino)-9-keto-thioxanthen-4-yl]methyl-methyl-sulfamoyl]ethyl ester Formula: C24H33N3O6S3 MolecularWeight: 555.73032

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCNC1=C2C(=C(C=C1)CN(C)S(=O)(=O)C(C)OS(=O)(=O)C)SC3=CC=CC=C3C2=O

Isomeric SMILES

CCN(CC)CCNC1=C2C(=C(C=C1)CN(C)S(=O)(=O)C(C)OS(=O)(=O)C)SC3=CC=CC=C3C2=O

InChI

InChI=1S/C24H33N3O6S3/c1-6-27(7-2)15-14-25-20-13-12-18(16-26(4)36(31,32)17(3)33-35(5,29)30)24-22(20)23(28)19-10-8-9-11-21(19)34-24/h8-13,17,25H,6-7,14-16H2,1-5H3