methyl 5-(1,3-benzoxazol-2-ylsulfanylmethyl)furan-2-carboxylate

Systemtic Name: methyl 5-(1,3-benzoxazol-2-ylsulfanylmethyl)furan-2-carboxylate Openeye Name: methyl 5-(1,3-benzoxazol-2-ylsulfanylmethyl)furan-2-carboxylate CAS Name: 5-[(1,3-benzoxazol-2-ylthio)methyl]-2-furancarboxylic acid methyl ester IUPAC Name: methyl 5-(1,3-benzoxazol-2-ylsulfanylmethyl)furan-2-carboxylate Traditional Name: 5-[(1,3-benzoxazol-2-ylthio)methyl]furan-2-carboxylic acid methyl ester Formula: C14H11NO4S MolecularWeight: 289.30644

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(O1)CSC2=NC3=CC=CC=C3O2

Isomeric SMILES

COC(=O)C1=CC=C(O1)CSC2=NC3=CC=CC=C3O2

InChI

InChI=1S/C14H11NO4S/c1-17-13(16)12-7-6-9(18-12)8-20-14-15-10-4-2-3-5-11(10)19-14/h2-7H,8H2,1H3