ethyl 2-[2-[(5-chloranyl-2-morpholin-4-yl-phenyl)amino]ethanoylamino]-5-ethyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-[(5-chloranyl-2-morpholin-4-yl-phenyl)amino]ethanoylamino]-5-ethyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-(5-chloro-2-morpholino-anilino)acetyl]amino]-5-ethyl-thiophene-3-carboxylate CAS Name: 2-[[2-[5-chloro-2-(4-morpholinyl)anilino]-1-oxoethyl]amino]-5-ethyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-(5-chloro-2-morpholin-4-ylanilino)acetyl]amino]-5-ethylthiophene-3-carboxylate Traditional Name: 2-[[2-(5-chloro-2-morpholino-anilino)acetyl]amino]-5-ethyl-thiophene-3-carboxylic acid ethyl ester Formula: C21H26ClN3O4S MolecularWeight: 451.96684

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(S1)NC(=O)CNC2=C(C=CC(=C2)Cl)N3CCOCC3)C(=O)OCC

Isomeric SMILES

CCC1=CC(=C(S1)NC(=O)CNC2=C(C=CC(=C2)Cl)N3CCOCC3)C(=O)OCC

InChI

InChI=1S/C21H26ClN3O4S/c1-3-15-12-16(21(27)29-4-2)20(30-15)24-19(26)13-23-17-11-14(22)5-6-18(17)25-7-9-28-10-8-25/h5-6,11-12,23H,3-4,7-10,13H2,1-2H3,(H,24,26)