methyl 3-(2-chlorophenyl)-3-[1-(4-imidazol-1-ylphenyl)ethylcarbamoylamino]propanoate

Systemtic Name: methyl 3-(2-chlorophenyl)-3-[1-(4-imidazol-1-ylphenyl)ethylcarbamoylamino]propanoate Openeye Name: methyl 3-(2-chlorophenyl)-3-[1-(4-imidazol-1-ylphenyl)ethylcarbamoylamino]propanoate CAS Name: 3-(2-chlorophenyl)-3-[[[1-[4-(1-imidazolyl)phenyl]ethylamino]-oxomethyl]amino]propanoic acid methyl ester IUPAC Name: methyl 3-(2-chlorophenyl)-3-[1-(4-imidazol-1-ylphenyl)ethylcarbamoylamino]propanoate Traditional Name: 3-(2-chlorophenyl)-3-[1-(4-imidazol-1-ylphenyl)ethylcarbamoylamino]propionic acid methyl ester Formula: C22H23ClN4O3 MolecularWeight: 426.89602

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)N2C=CN=C2)NC(=O)NC(CC(=O)OC)C3=CC=CC=C3Cl

Isomeric SMILES

CC(C1=CC=C(C=C1)N2C=CN=C2)NC(=O)NC(CC(=O)OC)C3=CC=CC=C3Cl

InChI

InChI=1S/C22H23ClN4O3/c1-15(16-7-9-17(10-8-16)27-12-11-24-14-27)25-22(29)26-20(13-21(28)30-2)18-5-3-4-6-19(18)23/h3-12,14-15,20H,13H2,1-2H3,(H2,25,26,29)