(2R)-1-[2-methoxy-4-[(pyridin-2-ylmethylamino)methyl]phenoxy]-3-thiomorpholin-4-yl-propan-2-ol

Systemtic Name: (2R)-1-[2-methoxy-4-[(pyridin-2-ylmethylamino)methyl]phenoxy]-3-thiomorpholin-4-yl-propan-2-ol Openeye Name: (2R)-1-[2-methoxy-4-[(2-pyridylmethylamino)methyl]phenoxy]-3-thiomorpholino-propan-2-ol CAS Name: (2R)-1-[2-methoxy-4-[(2-pyridinylmethylamino)methyl]phenoxy]-3-thiomorpholin-4-yl-2-propanol IUPAC Name: (2R)-1-[2-methoxy-4-[(pyridin-2-ylmethylamino)methyl]phenoxy]-3-thiomorpholin-4-ylpropan-2-ol Traditional Name: (2R)-1-[2-methoxy-4-[(2-pyridylmethylamino)methyl]phenoxy]-3-thiomorpholino-propan-2-ol Formula: C21H29N3O3S MolecularWeight: 403.53826

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CNCC2=CC=CC=N2)OCC(CN3CCSCC3)O

Isomeric SMILES

COC1=C(C=CC(=C1)CNCC2=CC=CC=N2)OC[C@@H](CN3CCSCC3)O

InChI

InChI=1S/C21H29N3O3S/c1-26-21-12-17(13-22-14-18-4-2-3-7-23-18)5-6-20(21)27-16-19(25)15-24-8-10-28-11-9-24/h2-7,12,19,22,25H,8-11,13-16H2,1H3/t19-/m1/s1