methyl 5-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanylmethyl]furan-2-carboxylate

Systemtic Name: methyl 5-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanylmethyl]furan-2-carboxylate Openeye Name: methyl 5-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanylmethyl]furan-2-carboxylate CAS Name: 5-[[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)thio]methyl]-2-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)sulfanylmethyl]furan-2-carboxylate Traditional Name: 5-[[(4,5-dicyclopropyl-1,2,4-triazol-3-yl)thio]methyl]furan-2-carboxylic acid methyl ester Formula: C15H17N3O3S MolecularWeight: 319.37878

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(O1)CSC2=NN=C(N2C3CC3)C4CC4

Isomeric SMILES

COC(=O)C1=CC=C(O1)CSC2=NN=C(N2C3CC3)C4CC4

InChI

InChI=1S/C15H17N3O3S/c1-20-14(19)12-7-6-11(21-12)8-22-15-17-16-13(9-2-3-9)18(15)10-4-5-10/h6-7,9-10H,2-5,8H2,1H3