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

Systemtic Name: 1-methyl-2-[[4-(1,2,3-thiadiazol-4-yl)phenyl]methyl]-3,4-dihydro-1H-isoquinoline-6,7-diol Openeye Name: 1-methyl-2-[[4-(thiadiazol-4-yl)phenyl]methyl]-3,4-dihydro-1H-isoquinoline-6,7-diol CAS Name: 1-methyl-2-[[4-(4-thiadiazolyl)phenyl]methyl]-3,4-dihydro-1H-isoquinoline-6,7-diol IUPAC Name: 1-methyl-2-[[4-(thiadiazol-4-yl)phenyl]methyl]-3,4-dihydro-1H-isoquinoline-6,7-diol Traditional Name: 1-methyl-2-[4-(thiadiazol-4-yl)benzyl]-3,4-dihydro-1H-isoquinoline-6,7-diol Formula: C19H19N3O2S MolecularWeight: 353.43806

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2=CC(=C(C=C2CCN1CC3=CC=C(C=C3)C4=CSN=N4)O)O

Isomeric SMILES

CC1C2=CC(=C(C=C2CCN1CC3=CC=C(C=C3)C4=CSN=N4)O)O

InChI

InChI=1S/C19H19N3O2S/c1-12-16-9-19(24)18(23)8-15(16)6-7-22(12)10-13-2-4-14(5-3-13)17-11-25-21-20-17/h2-5,8-9,11-12,23-24H,6-7,10H2,1H3