(2-phenyl-1,3-thiazol-4-yl)methyl 3-[(4-methylphenyl)sulfonylamino]propanoate

Systemtic Name: (2-phenyl-1,3-thiazol-4-yl)methyl 3-[(4-methylphenyl)sulfonylamino]propanoate Openeye Name: (2-phenylthiazol-4-yl)methyl 3-(p-tolylsulfonylamino)propanoate CAS Name: 3-[(4-methylphenyl)sulfonylamino]propanoic acid (2-phenyl-4-thiazolyl)methyl ester IUPAC Name: (2-phenyl-1,3-thiazol-4-yl)methyl 3-[(4-methylphenyl)sulfonylamino]propanoate Traditional Name: 3-(tosylamino)propionic acid (2-phenylthiazol-4-yl)methyl ester Formula: C20H20N2O4S2 MolecularWeight: 416.5138

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NCCC(=O)OCC2=CSC(=N2)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NCCC(=O)OCC2=CSC(=N2)C3=CC=CC=C3

InChI

InChI=1S/C20H20N2O4S2/c1-15-7-9-18(10-8-15)28(24,25)21-12-11-19(23)26-13-17-14-27-20(22-17)16-5-3-2-4-6-16/h2-10,14,21H,11-13H2,1H3