(2-acetamido-1,3-thiazol-4-yl)methyl 2-[(3,4-dimethylphenyl)sulfonylamino]ethanoate

Systemtic Name: (2-acetamido-1,3-thiazol-4-yl)methyl 2-[(3,4-dimethylphenyl)sulfonylamino]ethanoate Openeye Name: (2-acetamidothiazol-4-yl)methyl 2-[(3,4-dimethylphenyl)sulfonylamino]acetate CAS Name: 2-[(3,4-dimethylphenyl)sulfonylamino]acetic acid (2-acetamido-4-thiazolyl)methyl ester IUPAC Name: (2-acetamido-1,3-thiazol-4-yl)methyl 2-[(3,4-dimethylphenyl)sulfonylamino]acetate Traditional Name: 2-[(3,4-dimethylphenyl)sulfonylamino]acetic acid (2-acetamidothiazol-4-yl)methyl ester Formula: C16H19N3O5S2 MolecularWeight: 397.46916

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NCC(=O)OCC2=CSC(=N2)NC(=O)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NCC(=O)OCC2=CSC(=N2)NC(=O)C)C

InChI

InChI=1S/C16H19N3O5S2/c1-10-4-5-14(6-11(10)2)26(22,23)17-7-15(21)24-8-13-9-25-16(19-13)18-12(3)20/h4-6,9,17H,7-8H2,1-3H3,(H,18,19,20)