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

Systemtic Name: ethyl 2-[2-(3-morpholin-4-ylpropylamino)ethanoylamino]-4-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-(3-morpholinopropylamino)acetyl]amino]-4-phenyl-thiophene-3-carboxylate CAS Name: 2-[[2-[3-(4-morpholinyl)propylamino]-1-oxoethyl]amino]-4-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-(3-morpholin-4-ylpropylamino)acetyl]amino]-4-phenylthiophene-3-carboxylate Traditional Name: 2-[[2-(3-morpholinopropylamino)acetyl]amino]-4-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C22H29N3O4S MolecularWeight: 431.54836

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H29N3O4S/c1-2-29-22(27)20-18(17-7-4-3-5-8-17)16-30-21(20)24-19(26)15-23-9-6-10-25-11-13-28-14-12-25/h3-5,7-8,16,23H,2,6,9-15H2,1H3,(H,24,26)