N-[[1-(2-diethylaminoethylamino)-9-oxidanylidene-thioxanthen-4-yl]methyl]-N-methyl-ethanesulfonamide

Systemtic Name: N-[[1-(2-diethylaminoethylamino)-9-oxidanylidene-thioxanthen-4-yl]methyl]-N-methyl-ethanesulfonamide Openeye Name: N-[[1-(2-diethylaminoethylamino)-9-oxo-thioxanthen-4-yl]methyl]-N-methyl-ethanesulfonamide CAS Name: N-[[1-(2-diethylaminoethylamino)-9-oxo-4-thioxanthenyl]methyl]-N-methylethanesulfonamide IUPAC Name: N-[[1-(2-diethylaminoethylamino)-9-oxothioxanthen-4-yl]methyl]-N-methylethanesulfonamide Traditional Name: N-[[1-(2-diethylaminoethylamino)-9-keto-thioxanthen-4-yl]methyl]-N-methyl-ethanesulfonamide Formula: C23H31N3O3S2 MolecularWeight: 461.64054

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H31N3O3S2/c1-5-26(6-2)15-14-24-19-13-12-17(16-25(4)31(28,29)7-3)23-21(19)22(27)18-10-8-9-11-20(18)30-23/h8-13,24H,5-7,14-16H2,1-4H3