1-[2-[[methyl(1H-pyrazol-5-ylmethyl)amino]methyl]phenoxy]-3-thiomorpholin-4-yl-propan-2-ol

Systemtic Name: 1-[2-[[methyl(1H-pyrazol-5-ylmethyl)amino]methyl]phenoxy]-3-thiomorpholin-4-yl-propan-2-ol Openeye Name: 1-[2-[[methyl(1H-pyrazol-5-ylmethyl)amino]methyl]phenoxy]-3-thiomorpholino-propan-2-ol CAS Name: 1-[2-[[methyl(1H-pyrazol-5-ylmethyl)amino]methyl]phenoxy]-3-thiomorpholin-4-yl-2-propanol IUPAC Name: 1-[2-[[methyl(1H-pyrazol-5-ylmethyl)amino]methyl]phenoxy]-3-thiomorpholin-4-ylpropan-2-ol Traditional Name: 1-[2-[[methyl(1H-pyrazol-5-ylmethyl)amino]methyl]phenoxy]-3-thiomorpholino-propan-2-ol Formula: C19H28N4O2S MolecularWeight: 376.51622

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1OCC(CN2CCSCC2)O)CC3=CC=NN3

Isomeric SMILES

CN(CC1=CC=CC=C1OCC(CN2CCSCC2)O)CC3=CC=NN3

InChI

InChI=1S/C19H28N4O2S/c1-22(13-17-6-7-20-21-17)12-16-4-2-3-5-19(16)25-15-18(24)14-23-8-10-26-11-9-23/h2-7,18,24H,8-15H2,1H3,(H,20,21)