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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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