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

Systemtic Name: methyl 3-[2-(2,2-dimethylpropanoylimino)-6-ethyl-1,3-benzothiazol-3-yl]propanoate Openeye Name: methyl 3-[2-(2,2-dimethylpropanoylimino)-6-ethyl-1,3-benzothiazol-3-yl]propanoate CAS Name: 3-[2-(2,2-dimethyl-1-oxopropyl)imino-6-ethyl-1,3-benzothiazol-3-yl]propanoic acid methyl ester IUPAC Name: methyl 3-[2-(2,2-dimethylpropanoylimino)-6-ethyl-1,3-benzothiazol-3-yl]propanoate Traditional Name: 3-(6-ethyl-2-pivaloylimino-1,3-benzothiazol-3-yl)propionic acid methyl ester Formula: C18H24N2O3S MolecularWeight: 348.45976

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)N(C(=NC(=O)C(C)(C)C)S2)CCC(=O)OC

Isomeric SMILES

CCC1=CC2=C(C=C1)N(C(=NC(=O)C(C)(C)C)S2)CCC(=O)OC

InChI

InChI=1S/C18H24N2O3S/c1-6-12-7-8-13-14(11-12)24-17(19-16(22)18(2,3)4)20(13)10-9-15(21)23-5/h7-8,11H,6,9-10H2,1-5H3