ethyl 4-aminocarbonyl-2-methyl-5-[2-[1-(2-methylpropyl)benzimidazol-2-yl]sulfanylethanoylamino]furan-3-carboxylate

Systemtic Name: ethyl 4-aminocarbonyl-2-methyl-5-[2-[1-(2-methylpropyl)benzimidazol-2-yl]sulfanylethanoylamino]furan-3-carboxylate Openeye Name: ethyl 4-carbamoyl-5-[[2-(1-isobutylbenzimidazol-2-yl)sulfanylacetyl]amino]-2-methyl-furan-3-carboxylate CAS Name: 4-carbamoyl-2-methyl-5-[[2-[[1-(2-methylpropyl)-2-benzimidazolyl]thio]-1-oxoethyl]amino]-3-furancarboxylic acid ethyl ester IUPAC Name: ethyl 4-carbamoyl-2-methyl-5-[[2-[1-(2-methylpropyl)benzimidazol-2-yl]sulfanylacetyl]amino]furan-3-carboxylate Traditional Name: 4-carbamoyl-5-[[2-[(1-isobutylbenzimidazol-2-yl)thio]acetyl]amino]-2-methyl-furan-3-carboxylic acid ethyl ester Formula: C22H26N4O5S MolecularWeight: 458.53064

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC(=C1C(=O)N)NC(=O)CSC2=NC3=CC=CC=C3N2CC(C)C)C

Isomeric SMILES

CCOC(=O)C1=C(OC(=C1C(=O)N)NC(=O)CSC2=NC3=CC=CC=C3N2CC(C)C)C

InChI

InChI=1S/C22H26N4O5S/c1-5-30-21(29)17-13(4)31-20(18(17)19(23)28)25-16(27)11-32-22-24-14-8-6-7-9-15(14)26(22)10-12(2)3/h6-9,12H,5,10-11H2,1-4H3,(H2,23,28)(H,25,27)