2,3-dimethoxy-6-[2-[(2S)-1-methylpyrrolidin-2-yl]ethylamino]thioxanthen-9-one

Systemtic Name: 2,3-dimethoxy-6-[2-[(2S)-1-methylpyrrolidin-2-yl]ethylamino]thioxanthen-9-one Openeye Name: 2,3-dimethoxy-6-[2-[(2S)-1-methylpyrrolidin-2-yl]ethylamino]thioxanthen-9-one CAS Name: 2,3-dimethoxy-6-[2-[(2S)-1-methyl-2-pyrrolidinyl]ethylamino]-9-thioxanthenone IUPAC Name: 2,3-dimethoxy-6-[2-[(2S)-1-methylpyrrolidin-2-yl]ethylamino]thioxanthen-9-one Traditional Name: 2,3-dimethoxy-6-[2-[(2S)-1-methylpyrrolidin-2-yl]ethylamino]thioxanthen-9-one Formula: C22H26N2O3S MolecularWeight: 398.51844

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCCC1CCNC2=CC3=C(C=C2)C(=O)C4=CC(=C(C=C4S3)OC)OC

Isomeric SMILES

CN1CCC[C@H]1CCNC2=CC3=C(C=C2)C(=O)C4=CC(=C(C=C4S3)OC)OC

InChI

InChI=1S/C22H26N2O3S/c1-24-10-4-5-15(24)8-9-23-14-6-7-16-20(11-14)28-21-13-19(27-3)18(26-2)12-17(21)22(16)25/h6-7,11-13,15,23H,4-5,8-10H2,1-3H3/t15-/m0/s1