methyl 2-acetamido-3-(2,1,3-benzothiadiazol-5-yl)-2-methyl-propanoate

Systemtic Name: methyl 2-acetamido-3-(2,1,3-benzothiadiazol-5-yl)-2-methyl-propanoate Openeye Name: methyl 2-acetamido-3-(2,1,3-benzothiadiazol-5-yl)-2-methyl-propanoate CAS Name: 2-acetamido-3-(2,1,3-benzothiadiazol-5-yl)-2-methylpropanoic acid methyl ester IUPAC Name: methyl 2-acetamido-3-(2,1,3-benzothiadiazol-5-yl)-2-methylpropanoate Traditional Name: 2-acetamido-2-methyl-3-piazthiol-5-yl-propionic acid methyl ester Formula: C13H15N3O3S MolecularWeight: 293.3415

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(C)(CC1=CC2=NSN=C2C=C1)C(=O)OC

Isomeric SMILES

CC(=O)NC(C)(CC1=CC2=NSN=C2C=C1)C(=O)OC

InChI

InChI=1S/C13H15N3O3S/c1-8(17)14-13(2,12(18)19-3)7-9-4-5-10-11(6-9)16-20-15-10/h4-6H,7H2,1-3H3,(H,14,17)