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

Systemtic Name: methyl 2-[6-bromanyl-2-(2,2-dimethylpropanoylimino)-1,3-benzothiazol-3-yl]ethanoate Openeye Name: methyl 2-[6-bromo-2-(2,2-dimethylpropanoylimino)-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[6-bromo-2-(2,2-dimethyl-1-oxopropyl)imino-1,3-benzothiazol-3-yl]acetic acid methyl ester IUPAC Name: methyl 2-[6-bromo-2-(2,2-dimethylpropanoylimino)-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-(6-bromo-2-pivaloylimino-1,3-benzothiazol-3-yl)acetic acid methyl ester Formula: C15H17BrN2O3S MolecularWeight: 385.27608

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)N=C1N(C2=C(S1)C=C(C=C2)Br)CC(=O)OC

Isomeric SMILES

CC(C)(C)C(=O)N=C1N(C2=C(S1)C=C(C=C2)Br)CC(=O)OC

InChI

InChI=1S/C15H17BrN2O3S/c1-15(2,3)13(20)17-14-18(8-12(19)21-4)10-6-5-9(16)7-11(10)22-14/h5-7H,8H2,1-4H3