N-ethylsulfonyl-7-[(4-fluoranyl-2-methyl-phenyl)amino]-6-(4-phenylpiperidin-1-yl)carbonyl-pyrazolo[1,5-a]pyrimidine-3-carboxamide

Systemtic Name: N-ethylsulfonyl-7-[(4-fluoranyl-2-methyl-phenyl)amino]-6-(4-phenylpiperidin-1-yl)carbonyl-pyrazolo[1,5-a]pyrimidine-3-carboxamide Openeye Name: N-ethylsulfonyl-7-(4-fluoro-2-methyl-anilino)-6-(4-phenylpiperidine-1-carbonyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide CAS Name: N-ethylsulfonyl-7-(4-fluoro-2-methylanilino)-6-[oxo-(4-phenyl-1-piperidinyl)methyl]-3-pyrazolo[1,5-a]pyrimidinecarboxamide IUPAC Name: N-ethylsulfonyl-7-(4-fluoro-2-methylanilino)-6-(4-phenylpiperidine-1-carbonyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide Traditional Name: N-esyl-7-(4-fluoro-2-methyl-anilino)-6-(4-phenylpiperidine-1-carbonyl)pyrazolo[1,5-a]pyrimidine-3-carboxamide Formula: C28H29FN6O4S MolecularWeight: 564.631063

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)NC(=O)C1=C2N=CC(=C(N2N=C1)NC3=C(C=C(C=C3)F)C)C(=O)N4CCC(CC4)C5=CC=CC=C5

Isomeric SMILES

CCS(=O)(=O)NC(=O)C1=C2N=CC(=C(N2N=C1)NC3=C(C=C(C=C3)F)C)C(=O)N4CCC(CC4)C5=CC=CC=C5

InChI

InChI=1S/C28H29FN6O4S/c1-3-40(38,39)33-27(36)22-17-31-35-25(22)30-16-23(26(35)32-24-10-9-21(29)15-18(24)2)28(37)34-13-11-20(12-14-34)19-7-5-4-6-8-19/h4-10,15-17,20,32H,3,11-14H2,1-2H3,(H,33,36)