9-[3-(dimethylamino)propyl]-2-phenylmethoxy-thioxanthen-9-ol

Systemtic Name: 9-[3-(dimethylamino)propyl]-2-phenylmethoxy-thioxanthen-9-ol Openeye Name: 2-benzyloxy-9-[3-(dimethylamino)propyl]thioxanthen-9-ol CAS Name: 9-[3-(dimethylamino)propyl]-2-phenylmethoxy-9-thioxanthenol IUPAC Name: 9-[3-(dimethylamino)propyl]-2-phenylmethoxythioxanthen-9-ol Traditional Name: 2-benzoxy-9-[3-(dimethylamino)propyl]thioxanthen-9-ol Formula: C25H27NO2S MolecularWeight: 405.55238

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCC1(C2=CC=CC=C2SC3=C1C=C(C=C3)OCC4=CC=CC=C4)O

Isomeric SMILES

CN(C)CCCC1(C2=CC=CC=C2SC3=C1C=C(C=C3)OCC4=CC=CC=C4)O

InChI

InChI=1S/C25H27NO2S/c1-26(2)16-8-15-25(27)21-11-6-7-12-23(21)29-24-14-13-20(17-22(24)25)28-18-19-9-4-3-5-10-19/h3-7,9-14,17,27H,8,15-16,18H2,1-2H3