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1,3-benzothiazol-2-ylmethyl 2-[(2,3,5,6-tetramethylphenyl)sulfonylamino]propanoate
1,3-benzothiazol-2-ylmethyl 2-[(2,3,5,6-tetramethylphenyl)sulfonylamino]propanoate
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Descriptors Computed from Structure
Canonical SMILES:
CC1=CC(=C(C(=C1C)S(=O)(=O)NC(C)C(=O)OCC2=NC3=CC=CC=C3S2)C)C
Isomeric SMILES
CC1=CC(=C(C(=C1C)S(=O)(=O)NC(C)C(=O)OCC2=NC3=CC=CC=C3S2)C)C
InChI
InChI=1S/C21H24N2O4S2/c1-12-10-13(2)15(4)20(14(12)3)29(25,26)23-16(5)21(24)27-11-19-22-17-8-6-7-9-18(17)28-19/h6-10,16,23H,11H2,1-5H3
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