ethyl 3-methyl-4-(methylcarbamoyl)-5-(4-phenylsulfanylbutanoylamino)thiophene-2-carboxylate

Systemtic Name: ethyl 3-methyl-4-(methylcarbamoyl)-5-(4-phenylsulfanylbutanoylamino)thiophene-2-carboxylate Openeye Name: ethyl 3-methyl-4-(methylcarbamoyl)-5-(4-phenylsulfanylbutanoylamino)thiophene-2-carboxylate CAS Name: 3-methyl-4-(methylcarbamoyl)-5-[[1-oxo-4-(phenylthio)butyl]amino]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 3-methyl-4-(methylcarbamoyl)-5-(4-phenylsulfanylbutanoylamino)thiophene-2-carboxylate Traditional Name: 3-methyl-4-(methylcarbamoyl)-5-[4-(phenylthio)butanoylamino]thiophene-2-carboxylic acid ethyl ester Formula: C20H24N2O4S2 MolecularWeight: 420.54556

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)NC(=O)CCCSC2=CC=CC=C2)C(=O)NC)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)NC(=O)CCCSC2=CC=CC=C2)C(=O)NC)C

InChI

InChI=1S/C20H24N2O4S2/c1-4-26-20(25)17-13(2)16(18(24)21-3)19(28-17)22-15(23)11-8-12-27-14-9-6-5-7-10-14/h5-7,9-10H,4,8,11-12H2,1-3H3,(H,21,24)(H,22,23)