N-(1-phenylethyl)-6-[3-[(phenylmethyl)amino]phenyl]-7H-pyrrolo[2,3-d]pyrimidin-4-amine

Systemtic Name: N-(1-phenylethyl)-6-[3-[(phenylmethyl)amino]phenyl]-7H-pyrrolo[2,3-d]pyrimidin-4-amine Openeye Name: 6-[3-(benzylamino)phenyl]-N-(1-phenylethyl)-7H-pyrrolo[2,3-d]pyrimidin-4-amine CAS Name: N-(1-phenylethyl)-6-[3-[(phenylmethyl)amino]phenyl]-7H-pyrrolo[2,3-d]pyrimidin-4-amine IUPAC Name: 6-[3-(benzylamino)phenyl]-N-(1-phenylethyl)-7H-pyrrolo[2,3-d]pyrimidin-4-amine Traditional Name: benzyl-[3-[4-(1-phenylethylamino)-7H-pyrrolo[2,3-d]pyrimidin-6-yl]phenyl]amine Formula: C27H25N5 MolecularWeight: 419.5209

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC2=NC=NC3=C2C=C(N3)C4=CC(=CC=C4)NCC5=CC=CC=C5

Isomeric SMILES

CC(C1=CC=CC=C1)NC2=NC=NC3=C2C=C(N3)C4=CC(=CC=C4)NCC5=CC=CC=C5

InChI

InChI=1S/C27H25N5/c1-19(21-11-6-3-7-12-21)31-26-24-16-25(32-27(24)30-18-29-26)22-13-8-14-23(15-22)28-17-20-9-4-2-5-10-20/h2-16,18-19,28H,17H2,1H3,(H2,29,30,31,32)