1-[2-methoxy-4-[[methyl-[(1-methylpyrazol-4-yl)methyl]amino]methyl]phenoxy]-3-thiomorpholin-4-yl-propan-2-ol

Systemtic Name: 1-[2-methoxy-4-[[methyl-[(1-methylpyrazol-4-yl)methyl]amino]methyl]phenoxy]-3-thiomorpholin-4-yl-propan-2-ol Openeye Name: 1-[2-methoxy-4-[[methyl-[(1-methylpyrazol-4-yl)methyl]amino]methyl]phenoxy]-3-thiomorpholino-propan-2-ol CAS Name: 1-[2-methoxy-4-[[methyl-[(1-methyl-4-pyrazolyl)methyl]amino]methyl]phenoxy]-3-thiomorpholin-4-yl-2-propanol IUPAC Name: 1-[2-methoxy-4-[[methyl-[(1-methylpyrazol-4-yl)methyl]amino]methyl]phenoxy]-3-thiomorpholin-4-ylpropan-2-ol Traditional Name: 1-[2-methoxy-4-[[methyl-[(1-methylpyrazol-4-yl)methyl]amino]methyl]phenoxy]-3-thiomorpholino-propan-2-ol Formula: C21H32N4O3S MolecularWeight: 420.56878

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)CN(C)CC2=CC(=C(C=C2)OCC(CN3CCSCC3)O)OC

Isomeric SMILES

CN1C=C(C=N1)CN(C)CC2=CC(=C(C=C2)OCC(CN3CCSCC3)O)OC

InChI

InChI=1S/C21H32N4O3S/c1-23(13-18-11-22-24(2)14-18)12-17-4-5-20(21(10-17)27-3)28-16-19(26)15-25-6-8-29-9-7-25/h4-5,10-11,14,19,26H,6-9,12-13,15-16H2,1-3H3