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

Systemtic Name: 3-[4-ethoxy-3-(1-methyl-7-oxidanylidene-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)phenyl]-1,1-diethyl-2-phenyl-guanidine Openeye Name: 3-[4-ethoxy-3-(1-methyl-7-oxo-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)phenyl]-1,1-diethyl-2-phenyl-guanidine CAS Name: 3-[4-ethoxy-3-(1-methyl-7-oxo-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)phenyl]-1,1-diethyl-2-phenylguanidine IUPAC Name: 3-[4-ethoxy-3-(1-methyl-7-oxo-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)phenyl]-1,1-diethyl-2-phenylguanidine Traditional Name: 3-[4-ethoxy-3-(7-keto-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)phenyl]-1,1-diethyl-2-phenyl-guanidine Formula: C28H35N7O2 MolecularWeight: 501.6232

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C2=C1NC(=NC2=O)C3=C(C=CC(=C3)NC(=NC4=CC=CC=C4)N(CC)CC)OCC)C

Isomeric SMILES

CCCC1=NN(C2=C1NC(=NC2=O)C3=C(C=CC(=C3)NC(=NC4=CC=CC=C4)N(CC)CC)OCC)C

InChI

InChI=1S/C28H35N7O2/c1-6-13-22-24-25(34(5)33-22)27(36)32-26(31-24)21-18-20(16-17-23(21)37-9-4)30-28(35(7-2)8-3)29-19-14-11-10-12-15-19/h10-12,14-18H,6-9,13H2,1-5H3,(H,29,30)(H,31,32,36)