3-(3-imidazol-1-ylpropyl)-5,6-diphenyl-7-(phenylmethyl)pyrrolo[2,3-d]pyrimidin-4-imine

Systemtic Name: 3-(3-imidazol-1-ylpropyl)-5,6-diphenyl-7-(phenylmethyl)pyrrolo[2,3-d]pyrimidin-4-imine Openeye Name: 7-benzyl-3-(3-imidazol-1-ylpropyl)-5,6-diphenyl-pyrrolo[2,3-d]pyrimidin-4-imine CAS Name: 3-[3-(1-imidazolyl)propyl]-5,6-diphenyl-7-(phenylmethyl)-4-pyrrolo[2,3-d]pyrimidinimine IUPAC Name: 7-benzyl-3-(3-imidazol-1-ylpropyl)-5,6-diphenylpyrrolo[2,3-d]pyrimidin-4-imine Traditional Name: [7-benzyl-3-(3-imidazol-1-ylpropyl)-5,6-diphenyl-pyrrolo[2,3-d]pyrimidin-4-ylidene]amine Formula: C31H28N6 MolecularWeight: 484.59422

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=C(C3=C2N=CN(C3=N)CCCN4C=CN=C4)C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=C(C3=C2N=CN(C3=N)CCCN4C=CN=C4)C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C31H28N6/c32-30-28-27(25-13-6-2-7-14-25)29(26-15-8-3-9-16-26)37(21-24-11-4-1-5-12-24)31(28)34-23-36(30)19-10-18-35-20-17-33-22-35/h1-9,11-17,20,22-23,32H,10,18-19,21H2