ethyl 7-[3-[(4-iodanyl-1-methyl-pyrazol-3-yl)carbonylamino]phenyl]pyrazolo[1,5-a]pyrimidine-3-carboxylate

Systemtic Name: ethyl 7-[3-[(4-iodanyl-1-methyl-pyrazol-3-yl)carbonylamino]phenyl]pyrazolo[1,5-a]pyrimidine-3-carboxylate Openeye Name: ethyl 7-[3-[(4-iodo-1-methyl-pyrazole-3-carbonyl)amino]phenyl]pyrazolo[1,5-a]pyrimidine-3-carboxylate CAS Name: 7-[3-[[(4-iodo-1-methyl-3-pyrazolyl)-oxomethyl]amino]phenyl]-3-pyrazolo[1,5-a]pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 7-[3-[(4-iodo-1-methylpyrazole-3-carbonyl)amino]phenyl]pyrazolo[1,5-a]pyrimidine-3-carboxylate Traditional Name: 7-[3-[(4-iodo-1-methyl-pyrazole-3-carbonyl)amino]phenyl]pyrazolo[1,5-a]pyrimidine-3-carboxylic acid ethyl ester Formula: C20H17IN6O3 MolecularWeight: 516.29185

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C2N=CC=C(N2N=C1)C3=CC(=CC=C3)NC(=O)C4=NN(C=C4I)C

Isomeric SMILES

CCOC(=O)C1=C2N=CC=C(N2N=C1)C3=CC(=CC=C3)NC(=O)C4=NN(C=C4I)C

InChI

InChI=1S/C20H17IN6O3/c1-3-30-20(29)14-10-23-27-16(7-8-22-18(14)27)12-5-4-6-13(9-12)24-19(28)17-15(21)11-26(2)25-17/h4-11H,3H2,1-2H3,(H,24,28)