4-[[(5-ethyl-1,3-dimethyl-pyrazolo[4,3-d]pyrimidin-7-yl)amino]methyl]benzenesulfonamide

Systemtic Name: 4-[[(5-ethyl-1,3-dimethyl-pyrazolo[4,3-d]pyrimidin-7-yl)amino]methyl]benzenesulfonamide Openeye Name: 4-[[(5-ethyl-1,3-dimethyl-pyrazolo[4,3-d]pyrimidin-7-yl)amino]methyl]benzenesulfonamide CAS Name: 4-[[(5-ethyl-1,3-dimethyl-7-pyrazolo[4,3-d]pyrimidinyl)amino]methyl]benzenesulfonamide IUPAC Name: 4-[[(5-ethyl-1,3-dimethylpyrazolo[4,3-d]pyrimidin-7-yl)amino]methyl]benzenesulfonamide Traditional Name: 4-[[(5-ethyl-1,3-dimethyl-pyrazolo[4,3-d]pyrimidin-7-yl)amino]methyl]benzenesulfonamide Formula: C16H20N6O2S MolecularWeight: 360.434

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(C(=N1)NCC3=CC=C(C=C3)S(=O)(=O)N)N(N=C2C)C

Isomeric SMILES

CCC1=NC2=C(C(=N1)NCC3=CC=C(C=C3)S(=O)(=O)N)N(N=C2C)C

InChI

InChI=1S/C16H20N6O2S/c1-4-13-19-14-10(2)21-22(3)15(14)16(20-13)18-9-11-5-7-12(8-6-11)25(17,23)24/h5-8H,4,9H2,1-3H3,(H2,17,23,24)(H,18,19,20)