N-[4-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)ethyl]phenyl]-5-methoxy-9-oxidanylidene-thioxanthene-4-carboxamide

Systemtic Name: N-[4-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)ethyl]phenyl]-5-methoxy-9-oxidanylidene-thioxanthene-4-carboxamide Openeye Name: N-[4-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)ethyl]phenyl]-5-methoxy-9-oxo-thioxanthene-4-carboxamide CAS Name: N-[4-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)ethyl]phenyl]-5-methoxy-9-oxo-4-thioxanthenecarboxamide IUPAC Name: N-[4-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)ethyl]phenyl]-5-methoxy-9-oxothioxanthene-4-carboxamide Traditional Name: N-[4-[2-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)ethyl]phenyl]-9-keto-5-methoxy-thioxanthene-4-carboxamide Formula: C34H32N2O5S MolecularWeight: 580.69328

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1SC3=C(C2=O)C=CC=C3C(=O)NC4=CC=C(C=C4)CCN5CCC6=CC(=C(C=C6C5)OC)OC

Isomeric SMILES

COC1=CC=CC2=C1SC3=C(C2=O)C=CC=C3C(=O)NC4=CC=C(C=C4)CCN5CCC6=CC(=C(C=C6C5)OC)OC

InChI

InChI=1S/C34H32N2O5S/c1-39-28-9-5-7-26-31(37)25-6-4-8-27(32(25)42-33(26)28)34(38)35-24-12-10-21(11-13-24)14-16-36-17-15-22-18-29(40-2)30(41-3)19-23(22)20-36/h4-13,18-19H,14-17,20H2,1-3H3,(H,35,38)