ethyl 4-(4-methylphenyl)-2-[2-(4-oxidanylidenepentanoyloxy)ethanoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4-(4-methylphenyl)-2-[2-(4-oxidanylidenepentanoyloxy)ethanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-(4-oxopentanoyloxy)acetyl]amino]-4-(p-tolyl)thiophene-3-carboxylate CAS Name: 2-[[2-(1,4-dioxopentoxy)-1-oxoethyl]amino]-4-(4-methylphenyl)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-methylphenyl)-2-[[2-(4-oxopentanoyloxy)acetyl]amino]thiophene-3-carboxylate Traditional Name: 2-[[2-(4-ketopentanoyloxy)acetyl]amino]-4-(p-tolyl)thiophene-3-carboxylic acid ethyl ester Formula: C21H23NO6S MolecularWeight: 417.47542

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)C)NC(=O)COC(=O)CCC(=O)C

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)C)NC(=O)COC(=O)CCC(=O)C

InChI

InChI=1S/C21H23NO6S/c1-4-27-21(26)19-16(15-8-5-13(2)6-9-15)12-29-20(19)22-17(24)11-28-18(25)10-7-14(3)23/h5-6,8-9,12H,4,7,10-11H2,1-3H3,(H,22,24)