methyl 5-(1H-benzimidazol-2-ylsulfanylmethyl)-2-methyl-furan-3-carboxylate

Systemtic Name: methyl 5-(1H-benzimidazol-2-ylsulfanylmethyl)-2-methyl-furan-3-carboxylate Openeye Name: methyl 5-(1H-benzimidazol-2-ylsulfanylmethyl)-2-methyl-furan-3-carboxylate CAS Name: 5-[(1H-benzimidazol-2-ylthio)methyl]-2-methyl-3-furancarboxylic acid methyl ester IUPAC Name: methyl 5-(1H-benzimidazol-2-ylsulfanylmethyl)-2-methylfuran-3-carboxylate Traditional Name: 5-[(1H-benzimidazol-2-ylthio)methyl]-2-methyl-furan-3-carboxylic acid methyl ester Formula: C15H14N2O3S MolecularWeight: 302.34826

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)CSC2=NC3=CC=CC=C3N2)C(=O)OC

Isomeric SMILES

CC1=C(C=C(O1)CSC2=NC3=CC=CC=C3N2)C(=O)OC

InChI

InChI=1S/C15H14N2O3S/c1-9-11(14(18)19-2)7-10(20-9)8-21-15-16-12-5-3-4-6-13(12)17-15/h3-7H,8H2,1-2H3,(H,16,17)