3-butyl-7-(furan-2-ylmethyl)-5,6-diphenyl-pyrrolo[2,3-d]pyrimidin-4-imine

Systemtic Name: 3-butyl-7-(furan-2-ylmethyl)-5,6-diphenyl-pyrrolo[2,3-d]pyrimidin-4-imine Openeye Name: 3-butyl-7-(2-furylmethyl)-5,6-diphenyl-pyrrolo[2,3-d]pyrimidin-4-imine CAS Name: 3-butyl-7-(2-furanylmethyl)-5,6-diphenyl-4-pyrrolo[2,3-d]pyrimidinimine IUPAC Name: 3-butyl-7-(furan-2-ylmethyl)-5,6-diphenylpyrrolo[2,3-d]pyrimidin-4-imine Traditional Name: [3-butyl-7-(2-furfuryl)-5,6-diphenyl-pyrrolo[2,3-d]pyrimidin-4-ylidene]amine Formula: C27H26N4O MolecularWeight: 422.52154

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C=NC2=C(C1=N)C(=C(N2CC3=CC=CO3)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CCCCN1C=NC2=C(C1=N)C(=C(N2CC3=CC=CO3)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C27H26N4O/c1-2-3-16-30-19-29-27-24(26(30)28)23(20-11-6-4-7-12-20)25(21-13-8-5-9-14-21)31(27)18-22-15-10-17-32-22/h4-15,17,19,28H,2-3,16,18H2,1H3