dimethyl 5-[3-(5-azanyl-1-phenyl-pyrazol-3-yl)-2,5-dimethyl-pyrrol-1-yl]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[3-(5-azanyl-1-phenyl-pyrazol-3-yl)-2,5-dimethyl-pyrrol-1-yl]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[3-(5-amino-1-phenyl-pyrazol-3-yl)-2,5-dimethyl-pyrrol-1-yl]benzene-1,3-dicarboxylate CAS Name: 5-[3-(5-amino-1-phenyl-3-pyrazolyl)-2,5-dimethyl-1-pyrrolyl]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[3-(5-amino-1-phenylpyrazol-3-yl)-2,5-dimethylpyrrol-1-yl]benzene-1,3-dicarboxylate Traditional Name: 5-[3-(5-amino-1-phenyl-pyrazol-3-yl)-2,5-dimethyl-pyrrol-1-yl]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C25H24N4O4 MolecularWeight: 444.48246

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC(=CC(=C2)C(=O)OC)C(=O)OC)C)C3=NN(C(=C3)N)C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=C(N1C2=CC(=CC(=C2)C(=O)OC)C(=O)OC)C)C3=NN(C(=C3)N)C4=CC=CC=C4

InChI

InChI=1S/C25H24N4O4/c1-15-10-21(22-14-23(26)29(27-22)19-8-6-5-7-9-19)16(2)28(15)20-12-17(24(30)32-3)11-18(13-20)25(31)33-4/h5-14H,26H2,1-4H3