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

Systemtic Name: 1-[4-ethoxy-3-(1-methyl-7-oxidanylidene-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)phenyl]-3-phenyl-2-(phenylmethyl)guanidine Openeye Name: 2-benzyl-1-[4-ethoxy-3-(1-methyl-7-oxo-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)phenyl]-3-phenyl-guanidine CAS Name: 1-[4-ethoxy-3-(1-methyl-7-oxo-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)phenyl]-3-phenyl-2-(phenylmethyl)guanidine IUPAC Name: 2-benzyl-1-[4-ethoxy-3-(1-methyl-7-oxo-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)phenyl]-3-phenylguanidine Traditional Name: 2-benzyl-1-[4-ethoxy-3-(7-keto-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)phenyl]-3-phenyl-guanidine Formula: C31H33N7O2 MolecularWeight: 535.63942

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C2=C1NC(=NC2=O)C3=C(C=CC(=C3)NC(=NCC4=CC=CC=C4)NC5=CC=CC=C5)OCC)C

Isomeric SMILES

CCCC1=NN(C2=C1NC(=NC2=O)C3=C(C=CC(=C3)NC(=NCC4=CC=CC=C4)NC5=CC=CC=C5)OCC)C

InChI

InChI=1S/C31H33N7O2/c1-4-12-25-27-28(38(3)37-25)30(39)36-29(35-27)24-19-23(17-18-26(24)40-5-2)34-31(33-22-15-10-7-11-16-22)32-20-21-13-8-6-9-14-21/h6-11,13-19H,4-5,12,20H2,1-3H3,(H2,32,33,34)(H,35,36,39)