2-[[4-(diethylamino)phenyl]carbonylamino]ethyl 3-chloranyl-1-benzothiophene-2-carboxylate

Systemtic Name: 2-[[4-(diethylamino)phenyl]carbonylamino]ethyl 3-chloranyl-1-benzothiophene-2-carboxylate Openeye Name: 2-[[4-(diethylamino)benzoyl]amino]ethyl 3-chlorobenzothiophene-2-carboxylate CAS Name: 3-chloro-1-benzothiophene-2-carboxylic acid 2-[[[4-(diethylamino)phenyl]-oxomethyl]amino]ethyl ester IUPAC Name: 2-[[4-(diethylamino)benzoyl]amino]ethyl 3-chloro-1-benzothiophene-2-carboxylate Traditional Name: 3-chlorobenzothiophene-2-carboxylic acid 2-[[4-(diethylamino)benzoyl]amino]ethyl ester Formula: C22H23ClN2O3S MolecularWeight: 430.94762

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC=C(C=C1)C(=O)NCCOC(=O)C2=C(C3=CC=CC=C3S2)Cl

Isomeric SMILES

CCN(CC)C1=CC=C(C=C1)C(=O)NCCOC(=O)C2=C(C3=CC=CC=C3S2)Cl

InChI

InChI=1S/C22H23ClN2O3S/c1-3-25(4-2)16-11-9-15(10-12-16)21(26)24-13-14-28-22(27)20-19(23)17-7-5-6-8-18(17)29-20/h5-12H,3-4,13-14H2,1-2H3,(H,24,26)