methyl 2-[6-acetamido-2-(2,2-dimethylpropanoylimino)-1,3-benzothiazol-3-yl]ethanoate

Systemtic Name: methyl 2-[6-acetamido-2-(2,2-dimethylpropanoylimino)-1,3-benzothiazol-3-yl]ethanoate Openeye Name: methyl 2-[6-acetamido-2-(2,2-dimethylpropanoylimino)-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[6-acetamido-2-(2,2-dimethyl-1-oxopropyl)imino-1,3-benzothiazol-3-yl]acetic acid methyl ester IUPAC Name: methyl 2-[6-acetamido-2-(2,2-dimethylpropanoylimino)-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-(6-acetamido-2-pivaloylimino-1,3-benzothiazol-3-yl)acetic acid methyl ester Formula: C17H21N3O4S MolecularWeight: 363.43134

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC2=C(C=C1)N(C(=NC(=O)C(C)(C)C)S2)CC(=O)OC

Isomeric SMILES

CC(=O)NC1=CC2=C(C=C1)N(C(=NC(=O)C(C)(C)C)S2)CC(=O)OC

InChI

InChI=1S/C17H21N3O4S/c1-10(21)18-11-6-7-12-13(8-11)25-16(19-15(23)17(2,3)4)20(12)9-14(22)24-5/h6-8H,9H2,1-5H3,(H,18,21)