ethyl 3-[6-ethoxy-2-(2-methylpropanoylimino)-1,3-benzothiazol-3-yl]propanoate

Systemtic Name: ethyl 3-[6-ethoxy-2-(2-methylpropanoylimino)-1,3-benzothiazol-3-yl]propanoate Openeye Name: ethyl 3-[6-ethoxy-2-(2-methylpropanoylimino)-1,3-benzothiazol-3-yl]propanoate CAS Name: 3-[6-ethoxy-2-(2-methyl-1-oxopropyl)imino-1,3-benzothiazol-3-yl]propanoic acid ethyl ester IUPAC Name: ethyl 3-[6-ethoxy-2-(2-methylpropanoylimino)-1,3-benzothiazol-3-yl]propanoate Traditional Name: 3-(6-ethoxy-2-isobutyrylimino-1,3-benzothiazol-3-yl)propionic acid ethyl ester Formula: C18H24N2O4S MolecularWeight: 364.45916

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N(C(=NC(=O)C(C)C)S2)CCC(=O)OCC

Isomeric SMILES

CCOC1=CC2=C(C=C1)N(C(=NC(=O)C(C)C)S2)CCC(=O)OCC

InChI

InChI=1S/C18H24N2O4S/c1-5-23-13-7-8-14-15(11-13)25-18(19-17(22)12(3)4)20(14)10-9-16(21)24-6-2/h7-8,11-12H,5-6,9-10H2,1-4H3