2-[4-[4-azanyl-5-(3-phenylmethoxyphenyl)pyrrolo[2,3-d]pyrimidin-7-yl]cyclohexyl]guanidine

Systemtic Name: 2-[4-[4-azanyl-5-(3-phenylmethoxyphenyl)pyrrolo[2,3-d]pyrimidin-7-yl]cyclohexyl]guanidine Openeye Name: 2-[4-[4-amino-5-(3-benzyloxyphenyl)pyrrolo[2,3-d]pyrimidin-7-yl]cyclohexyl]guanidine CAS Name: 2-[4-[4-amino-5-(3-phenylmethoxyphenyl)-7-pyrrolo[2,3-d]pyrimidinyl]cyclohexyl]guanidine IUPAC Name: 2-[4-[4-amino-5-(3-phenylmethoxyphenyl)pyrrolo[2,3-d]pyrimidin-7-yl]cyclohexyl]guanidine Traditional Name: 2-[4-[4-amino-5-(3-benzoxyphenyl)pyrrolo[2,3-d]pyrimidin-7-yl]cyclohexyl]guanidine Formula: C26H29N7O MolecularWeight: 455.55476

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1N=C(N)N)N2C=C(C3=C2N=CN=C3N)C4=CC(=CC=C4)OCC5=CC=CC=C5

Isomeric SMILES

C1CC(CCC1N=C(N)N)N2C=C(C3=C2N=CN=C3N)C4=CC(=CC=C4)OCC5=CC=CC=C5

InChI

InChI=1S/C26H29N7O/c27-24-23-22(18-7-4-8-21(13-18)34-15-17-5-2-1-3-6-17)14-33(25(23)31-16-30-24)20-11-9-19(10-12-20)32-26(28)29/h1-8,13-14,16,19-20H,9-12,15H2,(H2,27,30,31)(H4,28,29,32)