N,N-bis(2-hydroxyethyl)-3-(1-methyl-7-oxidanylidene-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)-4-propoxy-benzenesulfonamide

Systemtic Name: N,N-bis(2-hydroxyethyl)-3-(1-methyl-7-oxidanylidene-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)-4-propoxy-benzenesulfonamide Openeye Name: N,N-bis(2-hydroxyethyl)-3-(1-methyl-7-oxo-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)-4-propoxy-benzenesulfonamide CAS Name: N,N-bis(2-hydroxyethyl)-3-(1-methyl-7-oxo-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)-4-propoxybenzenesulfonamide IUPAC Name: N,N-bis(2-hydroxyethyl)-3-(1-methyl-7-oxo-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)-4-propoxybenzenesulfonamide Traditional Name: N,N-bis(2-hydroxyethyl)-3-(7-keto-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)-4-propoxy-benzenesulfonamide Formula: C22H31N5O6S MolecularWeight: 493.57644

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C2=C1NC(=NC2=O)C3=C(C=CC(=C3)S(=O)(=O)N(CCO)CCO)OCCC)C

Isomeric SMILES

CCCC1=NN(C2=C1NC(=NC2=O)C3=C(C=CC(=C3)S(=O)(=O)N(CCO)CCO)OCCC)C

InChI

InChI=1S/C22H31N5O6S/c1-4-6-17-19-20(26(3)25-17)22(30)24-21(23-19)16-14-15(7-8-18(16)33-13-5-2)34(31,32)27(9-11-28)10-12-29/h7-8,14,28-29H,4-6,9-13H2,1-3H3,(H,23,24,30)