methyl 3-(4,7-dimethoxy-2-pentanoylimino-1,3-benzothiazol-3-yl)propanoate

Systemtic Name: methyl 3-(4,7-dimethoxy-2-pentanoylimino-1,3-benzothiazol-3-yl)propanoate Openeye Name: methyl 3-(4,7-dimethoxy-2-pentanoylimino-1,3-benzothiazol-3-yl)propanoate CAS Name: 3-[4,7-dimethoxy-2-(1-oxopentylimino)-1,3-benzothiazol-3-yl]propanoic acid methyl ester IUPAC Name: methyl 3-(4,7-dimethoxy-2-pentanoylimino-1,3-benzothiazol-3-yl)propanoate Traditional Name: 3-(4,7-dimethoxy-2-valerylimino-1,3-benzothiazol-3-yl)propionic acid methyl ester Formula: C18H24N2O5S MolecularWeight: 380.45856

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)N=C1N(C2=C(C=CC(=C2S1)OC)OC)CCC(=O)OC

Isomeric SMILES

CCCCC(=O)N=C1N(C2=C(C=CC(=C2S1)OC)OC)CCC(=O)OC

InChI

InChI=1S/C18H24N2O5S/c1-5-6-7-14(21)19-18-20(11-10-15(22)25-4)16-12(23-2)8-9-13(24-3)17(16)26-18/h8-9H,5-7,10-11H2,1-4H3