methyl 5-[3-(1,3-benzothiazol-2-yl)propanoyloxymethyl]-2-methyl-furan-3-carboxylate

Systemtic Name: methyl 5-[3-(1,3-benzothiazol-2-yl)propanoyloxymethyl]-2-methyl-furan-3-carboxylate Openeye Name: methyl 5-[3-(1,3-benzothiazol-2-yl)propanoyloxymethyl]-2-methyl-furan-3-carboxylate CAS Name: 5-[[3-(1,3-benzothiazol-2-yl)-1-oxopropoxy]methyl]-2-methyl-3-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[3-(1,3-benzothiazol-2-yl)propanoyloxymethyl]-2-methylfuran-3-carboxylate Traditional Name: 5-[3-(1,3-benzothiazol-2-yl)propanoyloxymethyl]-2-methyl-furan-3-carboxylic acid methyl ester Formula: C18H17NO5S MolecularWeight: 359.39628

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)COC(=O)CCC2=NC3=CC=CC=C3S2)C(=O)OC

Isomeric SMILES

CC1=C(C=C(O1)COC(=O)CCC2=NC3=CC=CC=C3S2)C(=O)OC

InChI

InChI=1S/C18H17NO5S/c1-11-13(18(21)22-2)9-12(24-11)10-23-17(20)8-7-16-19-14-5-3-4-6-15(14)25-16/h3-6,9H,7-8,10H2,1-2H3