N-[4-[2-[1-(3,4-dimethoxyphenyl)ethylamino]ethyl]phenyl]-5-methoxy-9-oxidanylidene-thioxanthene-4-carboxamide

Systemtic Name: N-[4-[2-[1-(3,4-dimethoxyphenyl)ethylamino]ethyl]phenyl]-5-methoxy-9-oxidanylidene-thioxanthene-4-carboxamide Openeye Name: N-[4-[2-[1-(3,4-dimethoxyphenyl)ethylamino]ethyl]phenyl]-5-methoxy-9-oxo-thioxanthene-4-carboxamide CAS Name: N-[4-[2-[1-(3,4-dimethoxyphenyl)ethylamino]ethyl]phenyl]-5-methoxy-9-oxo-4-thioxanthenecarboxamide IUPAC Name: N-[4-[2-[1-(3,4-dimethoxyphenyl)ethylamino]ethyl]phenyl]-5-methoxy-9-oxothioxanthene-4-carboxamide Traditional Name: N-[4-[2-[1-(3,4-dimethoxyphenyl)ethylamino]ethyl]phenyl]-9-keto-5-methoxy-thioxanthene-4-carboxamide Formula: C33H32N2O5S MolecularWeight: 568.68258

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=C(C=C1)OC)OC)NCCC2=CC=C(C=C2)NC(=O)C3=CC=CC4=C3SC5=C(C4=O)C=CC=C5OC

Isomeric SMILES

CC(C1=CC(=C(C=C1)OC)OC)NCCC2=CC=C(C=C2)NC(=O)C3=CC=CC4=C3SC5=C(C4=O)C=CC=C5OC

InChI

InChI=1S/C33H32N2O5S/c1-20(22-13-16-27(38-2)29(19-22)40-4)34-18-17-21-11-14-23(15-12-21)35-33(37)26-9-5-7-24-30(36)25-8-6-10-28(39-3)32(25)41-31(24)26/h5-16,19-20,34H,17-18H2,1-4H3,(H,35,37)