2-[[7-(3-methylphenyl)-5-phenyl-pyrrolo[2,3-d]pyrimidin-4-yl]amino]butan-1-ol

Systemtic Name: 2-[[7-(3-methylphenyl)-5-phenyl-pyrrolo[2,3-d]pyrimidin-4-yl]amino]butan-1-ol Openeye Name: 2-[[7-(m-tolyl)-5-phenyl-pyrrolo[2,3-d]pyrimidin-4-yl]amino]butan-1-ol CAS Name: 2-[[7-(3-methylphenyl)-5-phenyl-4-pyrrolo[2,3-d]pyrimidinyl]amino]-1-butanol IUPAC Name: 2-[[7-(3-methylphenyl)-5-phenylpyrrolo[2,3-d]pyrimidin-4-yl]amino]butan-1-ol Traditional Name: 2-[[7-(m-tolyl)-5-phenyl-pyrrolo[2,3-d]pyrimidin-4-yl]amino]butan-1-ol Formula: C23H24N4O MolecularWeight: 372.46286

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)NC1=NC=NC2=C1C(=CN2C3=CC=CC(=C3)C)C4=CC=CC=C4

Isomeric SMILES

CCC(CO)NC1=NC=NC2=C1C(=CN2C3=CC=CC(=C3)C)C4=CC=CC=C4

InChI

InChI=1S/C23H24N4O/c1-3-18(14-28)26-22-21-20(17-9-5-4-6-10-17)13-27(23(21)25-15-24-22)19-11-7-8-16(2)12-19/h4-13,15,18,28H,3,14H2,1-2H3,(H,24,25,26)