ethyl 3-[2-(2,2-dimethylpropanoylimino)-6-propan-2-yl-1,3-benzothiazol-3-yl]propanoate

Systemtic Name: ethyl 3-[2-(2,2-dimethylpropanoylimino)-6-propan-2-yl-1,3-benzothiazol-3-yl]propanoate Openeye Name: ethyl 3-[2-(2,2-dimethylpropanoylimino)-6-isopropyl-1,3-benzothiazol-3-yl]propanoate CAS Name: 3-[2-(2,2-dimethyl-1-oxopropyl)imino-6-propan-2-yl-1,3-benzothiazol-3-yl]propanoic acid ethyl ester IUPAC Name: ethyl 3-[2-(2,2-dimethylpropanoylimino)-6-propan-2-yl-1,3-benzothiazol-3-yl]propanoate Traditional Name: 3-(6-isopropyl-2-pivaloylimino-1,3-benzothiazol-3-yl)propionic acid ethyl ester Formula: C20H28N2O3S MolecularWeight: 376.51292

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCN1C2=C(C=C(C=C2)C(C)C)SC1=NC(=O)C(C)(C)C

Isomeric SMILES

CCOC(=O)CCN1C2=C(C=C(C=C2)C(C)C)SC1=NC(=O)C(C)(C)C

InChI

InChI=1S/C20H28N2O3S/c1-7-25-17(23)10-11-22-15-9-8-14(13(2)3)12-16(15)26-19(22)21-18(24)20(4,5)6/h8-9,12-13H,7,10-11H2,1-6H3