1-[2-methoxy-4-[[(6-methylpyridin-2-yl)methylamino]methyl]phenoxy]-3-thiomorpholin-4-yl-propan-2-ol

Systemtic Name: 1-[2-methoxy-4-[[(6-methylpyridin-2-yl)methylamino]methyl]phenoxy]-3-thiomorpholin-4-yl-propan-2-ol Openeye Name: 1-[2-methoxy-4-[[(6-methyl-2-pyridyl)methylamino]methyl]phenoxy]-3-thiomorpholino-propan-2-ol CAS Name: 1-[2-methoxy-4-[[(6-methyl-2-pyridinyl)methylamino]methyl]phenoxy]-3-thiomorpholin-4-yl-2-propanol IUPAC Name: 1-[2-methoxy-4-[[(6-methylpyridin-2-yl)methylamino]methyl]phenoxy]-3-thiomorpholin-4-ylpropan-2-ol Traditional Name: 1-[2-methoxy-4-[[(6-methyl-2-pyridyl)methylamino]methyl]phenoxy]-3-thiomorpholino-propan-2-ol Formula: C22H31N3O3S MolecularWeight: 417.56484

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC=C1)CNCC2=CC(=C(C=C2)OCC(CN3CCSCC3)O)OC

Isomeric SMILES

CC1=NC(=CC=C1)CNCC2=CC(=C(C=C2)OCC(CN3CCSCC3)O)OC

InChI

InChI=1S/C22H31N3O3S/c1-17-4-3-5-19(24-17)14-23-13-18-6-7-21(22(12-18)27-2)28-16-20(26)15-25-8-10-29-11-9-25/h3-7,12,20,23,26H,8-11,13-16H2,1-2H3