2-[[2-(4-chlorophenyl)-1,3-thiazol-4-yl]methyl]-1-methyl-3,4-dihydro-1H-isoquinoline-6,7-diol

Systemtic Name: 2-[[2-(4-chlorophenyl)-1,3-thiazol-4-yl]methyl]-1-methyl-3,4-dihydro-1H-isoquinoline-6,7-diol Openeye Name: 2-[[2-(4-chlorophenyl)thiazol-4-yl]methyl]-1-methyl-3,4-dihydro-1H-isoquinoline-6,7-diol CAS Name: 2-[[2-(4-chlorophenyl)-4-thiazolyl]methyl]-1-methyl-3,4-dihydro-1H-isoquinoline-6,7-diol IUPAC Name: 2-[[2-(4-chlorophenyl)-1,3-thiazol-4-yl]methyl]-1-methyl-3,4-dihydro-1H-isoquinoline-6,7-diol Traditional Name: 2-[[2-(4-chlorophenyl)thiazol-4-yl]methyl]-1-methyl-3,4-dihydro-1H-isoquinoline-6,7-diol Formula: C20H19ClN2O2S MolecularWeight: 386.89506

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2=CC(=C(C=C2CCN1CC3=CSC(=N3)C4=CC=C(C=C4)Cl)O)O

Isomeric SMILES

CC1C2=CC(=C(C=C2CCN1CC3=CSC(=N3)C4=CC=C(C=C4)Cl)O)O

InChI

InChI=1S/C20H19ClN2O2S/c1-12-17-9-19(25)18(24)8-14(17)6-7-23(12)10-16-11-26-20(22-16)13-2-4-15(21)5-3-13/h2-5,8-9,11-12,24-25H,6-7,10H2,1H3