methyl 4-(4-fluorophenyl)-2-[2-(3-morpholin-4-ylpropylamino)ethanoylamino]thiophene-3-carboxylate

Systemtic Name: methyl 4-(4-fluorophenyl)-2-[2-(3-morpholin-4-ylpropylamino)ethanoylamino]thiophene-3-carboxylate Openeye Name: methyl 4-(4-fluorophenyl)-2-[[2-(3-morpholinopropylamino)acetyl]amino]thiophene-3-carboxylate CAS Name: 4-(4-fluorophenyl)-2-[[2-[3-(4-morpholinyl)propylamino]-1-oxoethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-(4-fluorophenyl)-2-[[2-(3-morpholin-4-ylpropylamino)acetyl]amino]thiophene-3-carboxylate Traditional Name: 4-(4-fluorophenyl)-2-[[2-(3-morpholinopropylamino)acetyl]amino]thiophene-3-carboxylic acid methyl ester Formula: C21H26FN3O4S MolecularWeight: 435.512243

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC=C1C2=CC=C(C=C2)F)NC(=O)CNCCCN3CCOCC3

Isomeric SMILES

COC(=O)C1=C(SC=C1C2=CC=C(C=C2)F)NC(=O)CNCCCN3CCOCC3

InChI

InChI=1S/C21H26FN3O4S/c1-28-21(27)19-17(15-3-5-16(22)6-4-15)14-30-20(19)24-18(26)13-23-7-2-8-25-9-11-29-12-10-25/h3-6,14,23H,2,7-13H2,1H3,(H,24,26)