ethyl 3-[2-(4-chlorophenyl)sulfanylethanoylamino]-4-morpholin-4-yl-benzoate

Systemtic Name: ethyl 3-[2-(4-chlorophenyl)sulfanylethanoylamino]-4-morpholin-4-yl-benzoate Openeye Name: ethyl 3-[[2-(4-chlorophenyl)sulfanylacetyl]amino]-4-morpholino-benzoate CAS Name: 3-[[2-[(4-chlorophenyl)thio]-1-oxoethyl]amino]-4-(4-morpholinyl)benzoic acid ethyl ester IUPAC Name: ethyl 3-[[2-(4-chlorophenyl)sulfanylacetyl]amino]-4-morpholin-4-ylbenzoate Traditional Name: 3-[[2-[(4-chlorophenyl)thio]acetyl]amino]-4-morpholino-benzoic acid ethyl ester Formula: C21H23ClN2O4S MolecularWeight: 434.93632

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C=C1)N2CCOCC2)NC(=O)CSC3=CC=C(C=C3)Cl

Isomeric SMILES

CCOC(=O)C1=CC(=C(C=C1)N2CCOCC2)NC(=O)CSC3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H23ClN2O4S/c1-2-28-21(26)15-3-8-19(24-9-11-27-12-10-24)18(13-15)23-20(25)14-29-17-6-4-16(22)5-7-17/h3-8,13H,2,9-12,14H2,1H3,(H,23,25)