methyl 2-[3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)propanoylamino]-3-(1H-indol-3-yl)propanoate

Systemtic Name: methyl 2-[3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)propanoylamino]-3-(1H-indol-3-yl)propanoate Openeye Name: methyl 2-[3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)propanoylamino]-3-(1H-indol-3-yl)propanoate CAS Name: 2-[[3-(3,5-dimethyl-1-phenyl-4-pyrazolyl)-1-oxopropyl]amino]-3-(1H-indol-3-yl)propanoic acid methyl ester IUPAC Name: methyl 2-[3-(3,5-dimethyl-1-phenylpyrazol-4-yl)propanoylamino]-3-(1H-indol-3-yl)propanoate Traditional Name: 2-[3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)propanoylamino]-3-(1H-indol-3-yl)propionic acid methyl ester Formula: C26H28N4O3 MolecularWeight: 444.52552

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)CCC(=O)NC(CC3=CNC4=CC=CC=C43)C(=O)OC

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)CCC(=O)NC(CC3=CNC4=CC=CC=C43)C(=O)OC

InChI

InChI=1S/C26H28N4O3/c1-17-21(18(2)30(29-17)20-9-5-4-6-10-20)13-14-25(31)28-24(26(32)33-3)15-19-16-27-23-12-8-7-11-22(19)23/h4-12,16,24,27H,13-15H2,1-3H3,(H,28,31)