methyl 2-[(3-oxidanylidene-2-phenyl-1H-pyrazol-5-yl)carbonylamino]-3-[1-(phenylmethyl)imidazol-4-yl]propanoate

Systemtic Name: methyl 2-[(3-oxidanylidene-2-phenyl-1H-pyrazol-5-yl)carbonylamino]-3-[1-(phenylmethyl)imidazol-4-yl]propanoate Openeye Name: methyl 3-(1-benzylimidazol-4-yl)-2-[(3-oxo-2-phenyl-1H-pyrazole-5-carbonyl)amino]propanoate CAS Name: 2-[[oxo-(3-oxo-2-phenyl-1H-pyrazol-5-yl)methyl]amino]-3-[1-(phenylmethyl)-4-imidazolyl]propanoic acid methyl ester IUPAC Name: methyl 3-(1-benzylimidazol-4-yl)-2-[(3-oxo-2-phenyl-1H-pyrazole-5-carbonyl)amino]propanoate Traditional Name: 3-(1-benzylimidazol-4-yl)-2-[(5-keto-1-phenyl-3-pyrazoline-3-carbonyl)amino]propionic acid methyl ester Formula: C24H23N5O4 MolecularWeight: 445.47052

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CN(C=N1)CC2=CC=CC=C2)NC(=O)C3=CC(=O)N(N3)C4=CC=CC=C4

Isomeric SMILES

COC(=O)C(CC1=CN(C=N1)CC2=CC=CC=C2)NC(=O)C3=CC(=O)N(N3)C4=CC=CC=C4

InChI

InChI=1S/C24H23N5O4/c1-33-24(32)21(12-18-15-28(16-25-18)14-17-8-4-2-5-9-17)26-23(31)20-13-22(30)29(27-20)19-10-6-3-7-11-19/h2-11,13,15-16,21,27H,12,14H2,1H3,(H,26,31)