N-[[1-(2-diethylaminoethylamino)-6-methyl-9-oxidanylidene-thioxanthen-4-yl]methyl]methanesulfonamide

Systemtic Name: N-[[1-(2-diethylaminoethylamino)-6-methyl-9-oxidanylidene-thioxanthen-4-yl]methyl]methanesulfonamide Openeye Name: N-[[1-(2-diethylaminoethylamino)-6-methyl-9-oxo-thioxanthen-4-yl]methyl]methanesulfonamide CAS Name: N-[[1-(2-diethylaminoethylamino)-6-methyl-9-oxo-4-thioxanthenyl]methyl]methanesulfonamide IUPAC Name: N-[[1-(2-diethylaminoethylamino)-6-methyl-9-oxothioxanthen-4-yl]methyl]methanesulfonamide Traditional Name: N-[[1-(2-diethylaminoethylamino)-9-keto-6-methyl-thioxanthen-4-yl]methyl]methanesulfonamide Formula: C22H29N3O3S2 MolecularWeight: 447.61396

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCNC1=C2C(=C(C=C1)CNS(=O)(=O)C)SC3=C(C2=O)C=CC(=C3)C

Isomeric SMILES

CCN(CC)CCNC1=C2C(=C(C=C1)CNS(=O)(=O)C)SC3=C(C2=O)C=CC(=C3)C

InChI

InChI=1S/C22H29N3O3S2/c1-5-25(6-2)12-11-23-18-10-8-16(14-24-30(4,27)28)22-20(18)21(26)17-9-7-15(3)13-19(17)29-22/h7-10,13,23-24H,5-6,11-12,14H2,1-4H3