5,6,7-trideuterio-4-(trideuteriomethyl)-1,3-benzothiazole

Systemtic Name: 5,6,7-trideuterio-4-(trideuteriomethyl)-1,3-benzothiazole Openeye Name: 5,6,7-trideuterio-4-(trideuteriomethyl)-1,3-benzothiazole CAS Name: 5,6,7-trideuterio-4-(trideuteriomethyl)-1,3-benzothiazole IUPAC Name: 5,6,7-trideuterio-4-(trideuteriomethyl)-1,3-benzothiazole Traditional Name: 5,6,7-trideuterio-4-(trideuteriomethyl)-1,3-benzothiazole Formula: C8H7NS MolecularWeight: 155.249851

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)SC=N2

Isomeric SMILES

[2H]C1=C(C(=C2C(=C1[2H])SC=N2)C([2H])([2H])[2H])[2H]

InChI

InChI=1S/C8H7NS/c1-6-3-2-4-7-8(6)9-5-10-7/h2-5H,1H3/i1D3,2D,3D,4D