ethyl 3-(2-cyclopropylcarbonylimino-6-ethyl-1,3-benzothiazol-3-yl)propanoate

Systemtic Name: ethyl 3-(2-cyclopropylcarbonylimino-6-ethyl-1,3-benzothiazol-3-yl)propanoate Openeye Name: ethyl 3-[2-(cyclopropanecarbonylimino)-6-ethyl-1,3-benzothiazol-3-yl]propanoate CAS Name: 3-[2-[cyclopropyl(oxo)methyl]imino-6-ethyl-1,3-benzothiazol-3-yl]propanoic acid ethyl ester IUPAC Name: ethyl 3-[2-(cyclopropanecarbonylimino)-6-ethyl-1,3-benzothiazol-3-yl]propanoate Traditional Name: 3-[2-(cyclopropanecarbonylimino)-6-ethyl-1,3-benzothiazol-3-yl]propionic acid ethyl ester Formula: C18H22N2O3S MolecularWeight: 346.44388

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)N(C(=NC(=O)C3CC3)S2)CCC(=O)OCC

Isomeric SMILES

CCC1=CC2=C(C=C1)N(C(=NC(=O)C3CC3)S2)CCC(=O)OCC

InChI

InChI=1S/C18H22N2O3S/c1-3-12-5-8-14-15(11-12)24-18(19-17(22)13-6-7-13)20(14)10-9-16(21)23-4-2/h5,8,11,13H,3-4,6-7,9-10H2,1-2H3