1-[2-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)phenoxy]-3-thiomorpholin-4-yl-propan-2-ol

Systemtic Name: 1-[2-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)phenoxy]-3-thiomorpholin-4-yl-propan-2-ol Openeye Name: 1-[2-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)phenoxy]-3-thiomorpholino-propan-2-ol CAS Name: 1-[2-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)phenoxy]-3-thiomorpholin-4-yl-2-propanol IUPAC Name: 1-[2-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)phenoxy]-3-thiomorpholin-4-ylpropan-2-ol Traditional Name: 1-[2-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)phenoxy]-3-thiomorpholino-propan-2-ol Formula: C23H30N2O2S MolecularWeight: 398.5615

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)CC3=CC=CC=C3OCC(CN4CCSCC4)O

Isomeric SMILES

C1CN(CC2=CC=CC=C21)CC3=CC=CC=C3OCC(CN4CCSCC4)O

InChI

InChI=1S/C23H30N2O2S/c26-22(17-24-11-13-28-14-12-24)18-27-23-8-4-3-7-21(23)16-25-10-9-19-5-1-2-6-20(19)15-25/h1-8,22,26H,9-18H2