methyl 5-[[(2-ethyl-6-methyl-phenyl)amino]carbamothioylsulfanylmethyl]furan-2-carboxylate

Systemtic Name: methyl 5-[[(2-ethyl-6-methyl-phenyl)amino]carbamothioylsulfanylmethyl]furan-2-carboxylate Openeye Name: methyl 5-[(2-ethyl-6-methyl-anilino)carbamothioylsulfanylmethyl]furan-2-carboxylate CAS Name: 5-[[[[(2-ethyl-6-methylphenyl)hydrazo]-sulfanylidenemethyl]thio]methyl]-2-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[(2-ethyl-6-methylanilino)carbamothioylsulfanylmethyl]furan-2-carboxylate Traditional Name: 5-[[(2-ethyl-6-methyl-anilino)thiocarbamoylthio]methyl]furan-2-carboxylic acid methyl ester Formula: C17H20N2O3S2 MolecularWeight: 364.4823

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NNC(=S)SCC2=CC=C(O2)C(=O)OC)C

Isomeric SMILES

CCC1=CC=CC(=C1NNC(=S)SCC2=CC=C(O2)C(=O)OC)C

InChI

InChI=1S/C17H20N2O3S2/c1-4-12-7-5-6-11(2)15(12)18-19-17(23)24-10-13-8-9-14(22-13)16(20)21-3/h5-9,18H,4,10H2,1-3H3,(H,19,23)