2-[4-(diethylamino)phenyl]-6-methyl-1,3-benzothiazole-7-sulfonic acid

Systemtic Name: 2-[4-(diethylamino)phenyl]-6-methyl-1,3-benzothiazole-7-sulfonic acid Openeye Name: 2-[4-(diethylamino)phenyl]-6-methyl-1,3-benzothiazole-7-sulfonic acid CAS Name: 2-[4-(diethylamino)phenyl]-6-methyl-1,3-benzothiazole-7-sulfonic acid IUPAC Name: 2-[4-(diethylamino)phenyl]-6-methyl-1,3-benzothiazole-7-sulfonic acid Traditional Name: 2-[4-(diethylamino)phenyl]-6-methyl-1,3-benzothiazole-7-sulfonic acid Formula: C18H20N2O3S2 MolecularWeight: 376.493

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC=C(C=C1)C2=NC3=C(S2)C(=C(C=C3)C)S(=O)(=O)O

Isomeric SMILES

CCN(CC)C1=CC=C(C=C1)C2=NC3=C(S2)C(=C(C=C3)C)S(=O)(=O)O

InChI

InChI=1S/C18H20N2O3S2/c1-4-20(5-2)14-9-7-13(8-10-14)18-19-15-11-6-12(3)17(16(15)24-18)25(21,22)23/h6-11H,4-5H2,1-3H3,(H,21,22,23)