1-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-1,2,3,4-tetrahydroisoquinoline-6,7-diol

Systemtic Name: 1-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-1,2,3,4-tetrahydroisoquinoline-6,7-diol Openeye Name: 1-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-1,2,3,4-tetrahydroisoquinoline-6,7-diol CAS Name: 1-[[(5-methyl-1,3,4-thiadiazol-2-yl)thio]methyl]-1,2,3,4-tetrahydroisoquinoline-6,7-diol IUPAC Name: 1-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]-1,2,3,4-tetrahydroisoquinoline-6,7-diol Traditional Name: 1-[[(5-methyl-1,3,4-thiadiazol-2-yl)thio]methyl]-1,2,3,4-tetrahydroisoquinoline-6,7-diol Formula: C13H15N3O2S2 MolecularWeight: 309.4071

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(S1)SCC2C3=CC(=C(C=C3CCN2)O)O

Isomeric SMILES

CC1=NN=C(S1)SCC2C3=CC(=C(C=C3CCN2)O)O

InChI

InChI=1S/C13H15N3O2S2/c1-7-15-16-13(20-7)19-6-10-9-5-12(18)11(17)4-8(9)2-3-14-10/h4-5,10,14,17-18H,2-3,6H2,1H3