N-[[1-(2-diethylaminoethylamino)-7-methoxy-9-oxidanylidene-thioxanthen-4-yl]methyl]methanamide

Systemtic Name: N-[[1-(2-diethylaminoethylamino)-7-methoxy-9-oxidanylidene-thioxanthen-4-yl]methyl]methanamide Openeye Name: N-[[1-(2-diethylaminoethylamino)-7-methoxy-9-oxo-thioxanthen-4-yl]methyl]formamide CAS Name: N-[[1-(2-diethylaminoethylamino)-7-methoxy-9-oxo-4-thioxanthenyl]methyl]formamide IUPAC Name: N-[[1-(2-diethylaminoethylamino)-7-methoxy-9-oxothioxanthen-4-yl]methyl]formamide Traditional Name: N-[[1-(2-diethylaminoethylamino)-9-keto-7-methoxy-thioxanthen-4-yl]methyl]formamide Formula: C22H27N3O3S MolecularWeight: 413.53308

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27N3O3S/c1-4-25(5-2)11-10-24-18-8-6-15(13-23-14-26)22-20(18)21(27)17-12-16(28-3)7-9-19(17)29-22/h6-9,12,14,24H,4-5,10-11,13H2,1-3H3,(H,23,26)