N-[3-(3-cyano-5,7-dimethyl-pyrazolo[1,5-a]pyrimidin-2-yl)propyl]naphthalene-2-sulfonamide

Systemtic Name: N-[3-(3-cyano-5,7-dimethyl-pyrazolo[1,5-a]pyrimidin-2-yl)propyl]naphthalene-2-sulfonamide Openeye Name: N-[3-(3-cyano-5,7-dimethyl-pyrazolo[1,5-a]pyrimidin-2-yl)propyl]naphthalene-2-sulfonamide CAS Name: N-[3-(3-cyano-5,7-dimethyl-2-pyrazolo[1,5-a]pyrimidinyl)propyl]-2-naphthalenesulfonamide IUPAC Name: N-[3-(3-cyano-5,7-dimethylpyrazolo[1,5-a]pyrimidin-2-yl)propyl]naphthalene-2-sulfonamide Traditional Name: N-[3-(3-cyano-5,7-dimethyl-pyrazolo[1,5-a]pyrimidin-2-yl)propyl]naphthalene-2-sulfonamide Formula: C22H21N5O2S MolecularWeight: 419.49944

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=C(C(=NN12)CCCNS(=O)(=O)C3=CC4=CC=CC=C4C=C3)C#N)C

Isomeric SMILES

CC1=CC(=NC2=C(C(=NN12)CCCNS(=O)(=O)C3=CC4=CC=CC=C4C=C3)C#N)C

InChI

InChI=1S/C22H21N5O2S/c1-15-12-16(2)27-22(25-15)20(14-23)21(26-27)8-5-11-24-30(28,29)19-10-9-17-6-3-4-7-18(17)13-19/h3-4,6-7,9-10,12-13,24H,5,8,11H2,1-2H3