propan-2-yl (3S)-3-(2-chlorophenyl)-3-[3-(1-phenylpyrazol-4-yl)propanoylamino]propanoate

Systemtic Name: propan-2-yl (3S)-3-(2-chlorophenyl)-3-[3-(1-phenylpyrazol-4-yl)propanoylamino]propanoate Openeye Name: isopropyl (3S)-3-(2-chlorophenyl)-3-[3-(1-phenylpyrazol-4-yl)propanoylamino]propanoate CAS Name: (3S)-3-(2-chlorophenyl)-3-[[1-oxo-3-(1-phenyl-4-pyrazolyl)propyl]amino]propanoic acid propan-2-yl ester IUPAC Name: propan-2-yl (3S)-3-(2-chlorophenyl)-3-[3-(1-phenylpyrazol-4-yl)propanoylamino]propanoate Traditional Name: (3S)-3-(2-chlorophenyl)-3-[3-(1-phenylpyrazol-4-yl)propanoylamino]propionic acid isopropyl ester Formula: C24H26ClN3O3 MolecularWeight: 439.93454

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)CC(C1=CC=CC=C1Cl)NC(=O)CCC2=CN(N=C2)C3=CC=CC=C3

Isomeric SMILES

CC(C)OC(=O)C[C@@H](C1=CC=CC=C1Cl)NC(=O)CCC2=CN(N=C2)C3=CC=CC=C3

InChI

InChI=1S/C24H26ClN3O3/c1-17(2)31-24(30)14-22(20-10-6-7-11-21(20)25)27-23(29)13-12-18-15-26-28(16-18)19-8-4-3-5-9-19/h3-11,15-17,22H,12-14H2,1-2H3,(H,27,29)/t22-/m0/s1