[2-[(4-morpholin-4-ylphenyl)amino]-2-oxidanylidene-ethyl] 3-(2-chlorophenyl)sulfanylpropanoate

Systemtic Name: [2-[(4-morpholin-4-ylphenyl)amino]-2-oxidanylidene-ethyl] 3-(2-chlorophenyl)sulfanylpropanoate Openeye Name: [2-(4-morpholinoanilino)-2-oxo-ethyl] 3-(2-chlorophenyl)sulfanylpropanoate CAS Name: 3-[(2-chlorophenyl)thio]propanoic acid [2-[4-(4-morpholinyl)anilino]-2-oxoethyl] ester IUPAC Name: [2-(4-morpholin-4-ylanilino)-2-oxoethyl] 3-(2-chlorophenyl)sulfanylpropanoate Traditional Name: 3-[(2-chlorophenyl)thio]propionic acid [2-keto-2-(4-morpholinoanilino)ethyl] ester Formula: C21H23ClN2O4S MolecularWeight: 434.93632

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=CC=C(C=C2)NC(=O)COC(=O)CCSC3=CC=CC=C3Cl

Isomeric SMILES

C1COCCN1C2=CC=C(C=C2)NC(=O)COC(=O)CCSC3=CC=CC=C3Cl

InChI

InChI=1S/C21H23ClN2O4S/c22-18-3-1-2-4-19(18)29-14-9-21(26)28-15-20(25)23-16-5-7-17(8-6-16)24-10-12-27-13-11-24/h1-8H,9-15H2,(H,23,25)