N-prop-2-ynyl-N-[3-(3-pyridin-4-ylcarbonylpyrazolo[1,5-a]pyrimidin-7-yl)phenyl]methanesulfonamide

Systemtic Name: N-prop-2-ynyl-N-[3-(3-pyridin-4-ylcarbonylpyrazolo[1,5-a]pyrimidin-7-yl)phenyl]methanesulfonamide Openeye Name: N-prop-2-ynyl-N-[3-[3-(pyridine-4-carbonyl)pyrazolo[1,5-a]pyrimidin-7-yl]phenyl]methanesulfonamide CAS Name: N-[3-[3-[oxo(pyridin-4-yl)methyl]-7-pyrazolo[1,5-a]pyrimidinyl]phenyl]-N-prop-2-ynylmethanesulfonamide IUPAC Name: N-prop-2-ynyl-N-[3-[3-(pyridine-4-carbonyl)pyrazolo[1,5-a]pyrimidin-7-yl]phenyl]methanesulfonamide Traditional Name: N-[3-(3-isonicotinoylpyrazolo[1,5-a]pyrimidin-7-yl)phenyl]-N-propargyl-methanesulfonamide Formula: C22H17N5O3S MolecularWeight: 431.46708

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CC#C)C1=CC=CC(=C1)C2=CC=NC3=C(C=NN23)C(=O)C4=CC=NC=C4

Isomeric SMILES

CS(=O)(=O)N(CC#C)C1=CC=CC(=C1)C2=CC=NC3=C(C=NN23)C(=O)C4=CC=NC=C4

InChI

InChI=1S/C22H17N5O3S/c1-3-13-26(31(2,29)30)18-6-4-5-17(14-18)20-9-12-24-22-19(15-25-27(20)22)21(28)16-7-10-23-11-8-16/h1,4-12,14-15H,13H2,2H3