methyl 2-[[3-(1-azanylethenyl)phenyl]methyl]-3-[(5-methyl-3-phenyl-1H-pyrazol-4-yl)carbonylamino]butanoate

Systemtic Name: methyl 2-[[3-(1-azanylethenyl)phenyl]methyl]-3-[(5-methyl-3-phenyl-1H-pyrazol-4-yl)carbonylamino]butanoate Openeye Name: methyl 2-[[3-(1-aminovinyl)phenyl]methyl]-3-[(5-methyl-3-phenyl-1H-pyrazole-4-carbonyl)amino]butanoate CAS Name: 2-[[3-(1-aminoethenyl)phenyl]methyl]-3-[[(5-methyl-3-phenyl-1H-pyrazol-4-yl)-oxomethyl]amino]butanoic acid methyl ester IUPAC Name: methyl 2-[[3-(1-aminoethenyl)phenyl]methyl]-3-[(5-methyl-3-phenyl-1H-pyrazole-4-carbonyl)amino]butanoate Traditional Name: 2-[3-(1-aminovinyl)benzyl]-3-[(5-methyl-3-phenyl-1H-pyrazole-4-carbonyl)amino]butyric acid methyl ester Formula: C25H28N4O3 MolecularWeight: 432.51482

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1)C2=CC=CC=C2)C(=O)NC(C)C(CC3=CC=CC(=C3)C(=C)N)C(=O)OC

Isomeric SMILES

CC1=C(C(=NN1)C2=CC=CC=C2)C(=O)NC(C)C(CC3=CC=CC(=C3)C(=C)N)C(=O)OC

InChI

InChI=1S/C25H28N4O3/c1-15(26)20-12-8-9-18(13-20)14-21(25(31)32-4)16(2)27-24(30)22-17(3)28-29-23(22)19-10-6-5-7-11-19/h5-13,16,21H,1,14,26H2,2-4H3,(H,27,30)(H,28,29)