1,2-benzothiazol-4-yl 2-[(4-methylphenyl)sulfonylamino]propanoate

Systemtic Name: 1,2-benzothiazol-4-yl 2-[(4-methylphenyl)sulfonylamino]propanoate Openeye Name: 1,2-benzothiazol-4-yl 2-(p-tolylsulfonylamino)propanoate CAS Name: 2-[(4-methylphenyl)sulfonylamino]propanoic acid 1,2-benzothiazol-4-yl ester IUPAC Name: 1,2-benzothiazol-4-yl 2-[(4-methylphenyl)sulfonylamino]propanoate Traditional Name: 2-(tosylamino)propionic acid 1,2-benzothiazol-4-yl ester Formula: C17H16N2O4S2 MolecularWeight: 376.44994

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(C)C(=O)OC2=C3C=NSC3=CC=C2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(C)C(=O)OC2=C3C=NSC3=CC=C2

InChI

InChI=1S/C17H16N2O4S2/c1-11-6-8-13(9-7-11)25(21,22)19-12(2)17(20)23-15-4-3-5-16-14(15)10-18-24-16/h3-10,12,19H,1-2H3