methyl 3-[4-aminocarbonyl-3-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-5-methyl-1-prop-2-enyl-pyrrol-2-yl]propanoate

Systemtic Name: methyl 3-[4-aminocarbonyl-3-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-5-methyl-1-prop-2-enyl-pyrrol-2-yl]propanoate Openeye Name: methyl 3-[1-allyl-4-carbamoyl-3-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-5-methyl-pyrrol-2-yl]propanoate CAS Name: 3-[4-carbamoyl-3-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-5-methyl-1-prop-2-enyl-2-pyrrolyl]propanoic acid methyl ester IUPAC Name: methyl 3-[4-carbamoyl-3-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-5-methyl-1-prop-2-enylpyrrol-2-yl]propanoate Traditional Name: 3-[1-allyl-4-carbamoyl-3-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)-5-methyl-pyrrol-2-yl]propionic acid methyl ester Formula: C24H28N4O4 MolecularWeight: 436.50352

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)C3=C(N(C(=C3C(=O)N)C)CC=C)CCC(=O)OC

Isomeric SMILES

CC1=C(C(=O)N(N1C)C2=CC=CC=C2)C3=C(N(C(=C3C(=O)N)C)CC=C)CCC(=O)OC

InChI

InChI=1S/C24H28N4O4/c1-6-14-27-16(3)20(23(25)30)22(18(27)12-13-19(29)32-5)21-15(2)26(4)28(24(21)31)17-10-8-7-9-11-17/h6-11H,1,12-14H2,2-5H3,(H2,25,30)