N-[[1-[1-(diethylamino)ethylamino]-7-methoxy-9-oxidanylidene-thioxanthen-4-yl]methyl]methanesulfonamide

Systemtic Name: N-[[1-[1-(diethylamino)ethylamino]-7-methoxy-9-oxidanylidene-thioxanthen-4-yl]methyl]methanesulfonamide Openeye Name: N-[[1-[1-(diethylamino)ethylamino]-7-methoxy-9-oxo-thioxanthen-4-yl]methyl]methanesulfonamide CAS Name: N-[[1-[1-(diethylamino)ethylamino]-7-methoxy-9-oxo-4-thioxanthenyl]methyl]methanesulfonamide IUPAC Name: N-[[1-[1-(diethylamino)ethylamino]-7-methoxy-9-oxothioxanthen-4-yl]methyl]methanesulfonamide Traditional Name: N-[[1-[1-(diethylamino)ethylamino]-9-keto-7-methoxy-thioxanthen-4-yl]methyl]methanesulfonamide Formula: C22H29N3O4S2 MolecularWeight: 463.61336

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(C)NC1=C2C(=C(C=C1)CNS(=O)(=O)C)SC3=C(C2=O)C=C(C=C3)OC

Isomeric SMILES

CCN(CC)C(C)NC1=C2C(=C(C=C1)CNS(=O)(=O)C)SC3=C(C2=O)C=C(C=C3)OC

InChI

InChI=1S/C22H29N3O4S2/c1-6-25(7-2)14(3)24-18-10-8-15(13-23-31(5,27)28)22-20(18)21(26)17-12-16(29-4)9-11-19(17)30-22/h8-12,14,23-24H,6-7,13H2,1-5H3