2-[3-(3-ethyl-1-methyl-7-oxidanylidene-4H-pyrazolo[4,3-d]pyrimidin-5-yl)-4-propoxy-phenyl]-1-(2-hydroxyethyl)-1-methyl-guanidine

Systemtic Name: 2-[3-(3-ethyl-1-methyl-7-oxidanylidene-4H-pyrazolo[4,3-d]pyrimidin-5-yl)-4-propoxy-phenyl]-1-(2-hydroxyethyl)-1-methyl-guanidine Openeye Name: 2-[3-(3-ethyl-1-methyl-7-oxo-4H-pyrazolo[4,3-d]pyrimidin-5-yl)-4-propoxy-phenyl]-1-(2-hydroxyethyl)-1-methyl-guanidine CAS Name: 2-[3-(3-ethyl-1-methyl-7-oxo-4H-pyrazolo[4,3-d]pyrimidin-5-yl)-4-propoxyphenyl]-1-(2-hydroxyethyl)-1-methylguanidine IUPAC Name: 2-[3-(3-ethyl-1-methyl-7-oxo-4H-pyrazolo[4,3-d]pyrimidin-5-yl)-4-propoxyphenyl]-1-(2-hydroxyethyl)-1-methylguanidine Traditional Name: 2-[3-(3-ethyl-7-keto-1-methyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)-4-propoxy-phenyl]-1-(2-hydroxyethyl)-1-methyl-guanidine Formula: C21H29N7O3 MolecularWeight: 427.50006

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)N=C(N)N(C)CCO)C2=NC(=O)C3=C(N2)C(=NN3C)CC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)N=C(N)N(C)CCO)C2=NC(=O)C3=C(N2)C(=NN3C)CC

InChI

InChI=1S/C21H29N7O3/c1-5-11-31-16-8-7-13(23-21(22)27(3)9-10-29)12-14(16)19-24-17-15(6-2)26-28(4)18(17)20(30)25-19/h7-8,12,29H,5-6,9-11H2,1-4H3,(H2,22,23)(H,24,25,30)