N-[3-(3-cyano-5,7-dimethyl-pyrazolo[1,5-a]pyrimidin-2-yl)propyl]-3-methyl-quinoline-8-sulfonamide

Systemtic Name: N-[3-(3-cyano-5,7-dimethyl-pyrazolo[1,5-a]pyrimidin-2-yl)propyl]-3-methyl-quinoline-8-sulfonamide Openeye Name: N-[3-(3-cyano-5,7-dimethyl-pyrazolo[1,5-a]pyrimidin-2-yl)propyl]-3-methyl-quinoline-8-sulfonamide CAS Name: N-[3-(3-cyano-5,7-dimethyl-2-pyrazolo[1,5-a]pyrimidinyl)propyl]-3-methyl-8-quinolinesulfonamide IUPAC Name: N-[3-(3-cyano-5,7-dimethylpyrazolo[1,5-a]pyrimidin-2-yl)propyl]-3-methylquinoline-8-sulfonamide Traditional Name: N-[3-(3-cyano-5,7-dimethyl-pyrazolo[1,5-a]pyrimidin-2-yl)propyl]-3-methyl-quinoline-8-sulfonamide Formula: C22H22N6O2S MolecularWeight: 434.51408

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=C(C(=NN12)CCCNS(=O)(=O)C3=CC=CC4=CC(=CN=C43)C)C#N)C

Isomeric SMILES

CC1=CC(=NC2=C(C(=NN12)CCCNS(=O)(=O)C3=CC=CC4=CC(=CN=C43)C)C#N)C

InChI

InChI=1S/C22H22N6O2S/c1-14-10-17-6-4-8-20(21(17)24-13-14)31(29,30)25-9-5-7-19-18(12-23)22-26-15(2)11-16(3)28(22)27-19/h4,6,8,10-11,13,25H,5,7,9H2,1-3H3