1-[4-[2-[1-(3,4-dimethoxyphenyl)ethylamino]ethoxy]phenyl]-9-oxidanylidene-thioxanthene-4-carboxamide

Systemtic Name: 1-[4-[2-[1-(3,4-dimethoxyphenyl)ethylamino]ethoxy]phenyl]-9-oxidanylidene-thioxanthene-4-carboxamide Openeye Name: 1-[4-[2-[1-(3,4-dimethoxyphenyl)ethylamino]ethoxy]phenyl]-9-oxo-thioxanthene-4-carboxamide CAS Name: 1-[4-[2-[1-(3,4-dimethoxyphenyl)ethylamino]ethoxy]phenyl]-9-oxo-4-thioxanthenecarboxamide IUPAC Name: 1-[4-[2-[1-(3,4-dimethoxyphenyl)ethylamino]ethoxy]phenyl]-9-oxothioxanthene-4-carboxamide Traditional Name: 1-[4-[2-[1-(3,4-dimethoxyphenyl)ethylamino]ethoxy]phenyl]-9-keto-thioxanthene-4-carboxamide Formula: C32H30N2O5S MolecularWeight: 554.656

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=C(C=C1)OC)OC)NCCOC2=CC=C(C=C2)C3=C4C(=C(C=C3)C(=O)N)SC5=CC=CC=C5C4=O

Isomeric SMILES

CC(C1=CC(=C(C=C1)OC)OC)NCCOC2=CC=C(C=C2)C3=C4C(=C(C=C3)C(=O)N)SC5=CC=CC=C5C4=O

InChI

InChI=1S/C32H30N2O5S/c1-19(21-10-15-26(37-2)27(18-21)38-3)34-16-17-39-22-11-8-20(9-12-22)23-13-14-25(32(33)36)31-29(23)30(35)24-6-4-5-7-28(24)40-31/h4-15,18-19,34H,16-17H2,1-3H3,(H2,33,36)