methyl 5-[4-(1,3-benzothiazol-2-yl)butanoyloxymethyl]-2-methyl-furan-3-carboxylate

Systemtic Name: methyl 5-[4-(1,3-benzothiazol-2-yl)butanoyloxymethyl]-2-methyl-furan-3-carboxylate Openeye Name: methyl 5-[4-(1,3-benzothiazol-2-yl)butanoyloxymethyl]-2-methyl-furan-3-carboxylate CAS Name: 5-[[4-(1,3-benzothiazol-2-yl)-1-oxobutoxy]methyl]-2-methyl-3-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[4-(1,3-benzothiazol-2-yl)butanoyloxymethyl]-2-methylfuran-3-carboxylate Traditional Name: 5-[4-(1,3-benzothiazol-2-yl)butanoyloxymethyl]-2-methyl-furan-3-carboxylic acid methyl ester Formula: C19H19NO5S MolecularWeight: 373.42286

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)COC(=O)CCCC2=NC3=CC=CC=C3S2)C(=O)OC

Isomeric SMILES

CC1=C(C=C(O1)COC(=O)CCCC2=NC3=CC=CC=C3S2)C(=O)OC

InChI

InChI=1S/C19H19NO5S/c1-12-14(19(22)23-2)10-13(25-12)11-24-18(21)9-5-8-17-20-15-6-3-4-7-16(15)26-17/h3-4,6-7,10H,5,8-9,11H2,1-2H3