ethyl 4-aminocarbonyl-2-methyl-5-[3-(4-methylquinolin-2-yl)sulfanylpropanoylamino]furan-3-carboxylate

Systemtic Name: ethyl 4-aminocarbonyl-2-methyl-5-[3-(4-methylquinolin-2-yl)sulfanylpropanoylamino]furan-3-carboxylate Openeye Name: ethyl 4-carbamoyl-2-methyl-5-[3-[(4-methyl-2-quinolyl)sulfanyl]propanoylamino]furan-3-carboxylate CAS Name: 4-carbamoyl-2-methyl-5-[[3-[(4-methyl-2-quinolinyl)thio]-1-oxopropyl]amino]-3-furancarboxylic acid ethyl ester IUPAC Name: ethyl 4-carbamoyl-2-methyl-5-[3-(4-methylquinolin-2-yl)sulfanylpropanoylamino]furan-3-carboxylate Traditional Name: 4-carbamoyl-2-methyl-5-[3-[(4-methyl-2-quinolyl)thio]propanoylamino]furan-3-carboxylic acid ethyl ester Formula: C22H23N3O5S MolecularWeight: 441.50012

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC(=C1C(=O)N)NC(=O)CCSC2=NC3=CC=CC=C3C(=C2)C)C

Isomeric SMILES

CCOC(=O)C1=C(OC(=C1C(=O)N)NC(=O)CCSC2=NC3=CC=CC=C3C(=C2)C)C

InChI

InChI=1S/C22H23N3O5S/c1-4-29-22(28)18-13(3)30-21(19(18)20(23)27)25-16(26)9-10-31-17-11-12(2)14-7-5-6-8-15(14)24-17/h5-8,11H,4,9-10H2,1-3H3,(H2,23,27)(H,25,26)