1-[4-ethoxy-3-(1-methyl-7-oxidanylidene-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)phenyl]-2-(3-oxidanylpropyl)guanidine

Systemtic Name: 1-[4-ethoxy-3-(1-methyl-7-oxidanylidene-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)phenyl]-2-(3-oxidanylpropyl)guanidine Openeye Name: 1-[4-ethoxy-3-(1-methyl-7-oxo-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)phenyl]-2-(3-hydroxypropyl)guanidine CAS Name: 1-[4-ethoxy-3-(1-methyl-7-oxo-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)phenyl]-2-(3-hydroxypropyl)guanidine IUPAC Name: 1-[4-ethoxy-3-(1-methyl-7-oxo-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)phenyl]-2-(3-hydroxypropyl)guanidine Traditional Name: 1-[4-ethoxy-3-(7-keto-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)phenyl]-2-(3-hydroxypropyl)guanidine Formula: C21H29N7O3 MolecularWeight: 427.50006

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C2=C1NC(=NC2=O)C3=C(C=CC(=C3)NC(=NCCCO)N)OCC)C

Isomeric SMILES

CCCC1=NN(C2=C1NC(=NC2=O)C3=C(C=CC(=C3)NC(=NCCCO)N)OCC)C

InChI

InChI=1S/C21H29N7O3/c1-4-7-15-17-18(28(3)27-15)20(30)26-19(25-17)14-12-13(8-9-16(14)31-5-2)24-21(22)23-10-6-11-29/h8-9,12,29H,4-7,10-11H2,1-3H3,(H3,22,23,24)(H,25,26,30)