ethyl 2-[2-(2,2-dimethylpropanoylimino)-6-methylsulfonyl-1,3-benzothiazol-3-yl]ethanoate

Systemtic Name: ethyl 2-[2-(2,2-dimethylpropanoylimino)-6-methylsulfonyl-1,3-benzothiazol-3-yl]ethanoate Openeye Name: ethyl 2-[2-(2,2-dimethylpropanoylimino)-6-methylsulfonyl-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[2-(2,2-dimethyl-1-oxopropyl)imino-6-methylsulfonyl-1,3-benzothiazol-3-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-(2,2-dimethylpropanoylimino)-6-methylsulfonyl-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-(6-mesyl-2-pivaloylimino-1,3-benzothiazol-3-yl)acetic acid ethyl ester Formula: C17H22N2O5S2 MolecularWeight: 398.49698

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C2=C(C=C(C=C2)S(=O)(=O)C)SC1=NC(=O)C(C)(C)C

Isomeric SMILES

CCOC(=O)CN1C2=C(C=C(C=C2)S(=O)(=O)C)SC1=NC(=O)C(C)(C)C

InChI

InChI=1S/C17H22N2O5S2/c1-6-24-14(20)10-19-12-8-7-11(26(5,22)23)9-13(12)25-16(19)18-15(21)17(2,3)4/h7-9H,6,10H2,1-5H3