methyl 5-[[2-[(3-ethylphenyl)amino]-2-oxidanylidene-ethyl]sulfanylmethyl]-2-methyl-furan-3-carboxylate

Systemtic Name: methyl 5-[[2-[(3-ethylphenyl)amino]-2-oxidanylidene-ethyl]sulfanylmethyl]-2-methyl-furan-3-carboxylate Openeye Name: methyl 5-[[2-(3-ethylanilino)-2-oxo-ethyl]sulfanylmethyl]-2-methyl-furan-3-carboxylate CAS Name: 5-[[[2-(3-ethylanilino)-2-oxoethyl]thio]methyl]-2-methyl-3-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[[2-(3-ethylanilino)-2-oxoethyl]sulfanylmethyl]-2-methylfuran-3-carboxylate Traditional Name: 5-[[[2-(3-ethylanilino)-2-keto-ethyl]thio]methyl]-2-methyl-furan-3-carboxylic acid methyl ester Formula: C18H21NO4S MolecularWeight: 347.42864

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)NC(=O)CSCC2=CC(=C(O2)C)C(=O)OC

Isomeric SMILES

CCC1=CC(=CC=C1)NC(=O)CSCC2=CC(=C(O2)C)C(=O)OC

InChI

InChI=1S/C18H21NO4S/c1-4-13-6-5-7-14(8-13)19-17(20)11-24-10-15-9-16(12(2)23-15)18(21)22-3/h5-9H,4,10-11H2,1-3H3,(H,19,20)