1-(2-diethylaminoethylamino)-7-methoxy-9-oxidanylidene-thioxanthene-4-carbaldehyde

Systemtic Name: 1-(2-diethylaminoethylamino)-7-methoxy-9-oxidanylidene-thioxanthene-4-carbaldehyde Openeye Name: 1-(2-diethylaminoethylamino)-7-methoxy-9-oxo-thioxanthene-4-carbaldehyde CAS Name: 1-(2-diethylaminoethylamino)-7-methoxy-9-oxo-4-thioxanthenecarboxaldehyde IUPAC Name: 1-(2-diethylaminoethylamino)-7-methoxy-9-oxothioxanthene-4-carbaldehyde Traditional Name: 1-(2-diethylaminoethylamino)-9-keto-7-methoxy-thioxanthene-4-carbaldehyde Formula: C21H24N2O3S MolecularWeight: 384.49186

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H24N2O3S/c1-4-23(5-2)11-10-22-17-8-6-14(13-24)21-19(17)20(25)16-12-15(26-3)7-9-18(16)27-21/h6-9,12-13,22H,4-5,10-11H2,1-3H3