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

Systemtic Name: 1-[3-(1-methyl-7-oxidanylidene-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)-4-propoxy-phenyl]-3-phenyl-2-(phenylmethyl)guanidine Openeye Name: 2-benzyl-1-[3-(1-methyl-7-oxo-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)-4-propoxy-phenyl]-3-phenyl-guanidine CAS Name: 1-[3-(1-methyl-7-oxo-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)-4-propoxyphenyl]-3-phenyl-2-(phenylmethyl)guanidine IUPAC Name: 2-benzyl-1-[3-(1-methyl-7-oxo-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)-4-propoxyphenyl]-3-phenylguanidine Traditional Name: 2-benzyl-1-[3-(7-keto-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)-4-propoxy-phenyl]-3-phenyl-guanidine Formula: C32H35N7O2 MolecularWeight: 549.666

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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)OCCC)C

Isomeric SMILES

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

InChI

InChI=1S/C32H35N7O2/c1-4-12-26-28-29(39(3)38-26)31(40)37-30(36-28)25-20-24(17-18-27(25)41-19-5-2)35-32(34-23-15-10-7-11-16-23)33-21-22-13-8-6-9-14-22/h6-11,13-18,20H,4-5,12,19,21H2,1-3H3,(H2,33,34,35)(H,36,37,40)