ethyl 4-(2-chlorophenyl)-2-[2-(3-morpholin-4-ylpropylamino)ethanoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4-(2-chlorophenyl)-2-[2-(3-morpholin-4-ylpropylamino)ethanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 4-(2-chlorophenyl)-2-[[2-(3-morpholinopropylamino)acetyl]amino]thiophene-3-carboxylate CAS Name: 4-(2-chlorophenyl)-2-[[2-[3-(4-morpholinyl)propylamino]-1-oxoethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(2-chlorophenyl)-2-[[2-(3-morpholin-4-ylpropylamino)acetyl]amino]thiophene-3-carboxylate Traditional Name: 4-(2-chlorophenyl)-2-[[2-(3-morpholinopropylamino)acetyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C22H28ClN3O4S MolecularWeight: 465.99342

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2Cl)NC(=O)CNCCCN3CCOCC3

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2Cl)NC(=O)CNCCCN3CCOCC3

InChI

InChI=1S/C22H28ClN3O4S/c1-2-30-22(28)20-17(16-6-3-4-7-18(16)23)15-31-21(20)25-19(27)14-24-8-5-9-26-10-12-29-13-11-26/h3-4,6-7,15,24H,2,5,8-14H2,1H3,(H,25,27)