[2-[(2-methyl-5-piperidin-1-ylsulfonyl-phenyl)amino]-2-oxidanylidene-ethyl] 5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxylate

Systemtic Name: [2-[(2-methyl-5-piperidin-1-ylsulfonyl-phenyl)amino]-2-oxidanylidene-ethyl] 5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxylate Openeye Name: [2-[2-methyl-5-(1-piperidylsulfonyl)anilino]-2-oxo-ethyl] 5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxylate CAS Name: 5,7-dimethyl-3-pyrazolo[1,5-a]pyrimidinecarboxylic acid [2-[2-methyl-5-(1-piperidinylsulfonyl)anilino]-2-oxoethyl] ester IUPAC Name: [2-(2-methyl-5-piperidin-1-ylsulfonylanilino)-2-oxoethyl] 5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxylate Traditional Name: 5,7-dimethylpyrazolo[1,5-a]pyrimidine-3-carboxylic acid [2-keto-2-(2-methyl-5-piperidinosulfonyl-anilino)ethyl] ester Formula: C23H27N5O5S MolecularWeight: 485.55598

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)COC(=O)C3=C4N=C(C=C(N4N=C3)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)COC(=O)C3=C4N=C(C=C(N4N=C3)C)C

InChI

InChI=1S/C23H27N5O5S/c1-15-7-8-18(34(31,32)27-9-5-4-6-10-27)12-20(15)26-21(29)14-33-23(30)19-13-24-28-17(3)11-16(2)25-22(19)28/h7-8,11-13H,4-6,9-10,14H2,1-3H3,(H,26,29)