N-(phenylmethyl)-4-(1H-pyrrolo[2,3-b]pyridin-3-yl)pyrimidin-2-amine

Systemtic Name: N-(phenylmethyl)-4-(1H-pyrrolo[2,3-b]pyridin-3-yl)pyrimidin-2-amine Openeye Name: N-benzyl-4-(1H-pyrrolo[2,3-b]pyridin-3-yl)pyrimidin-2-amine CAS Name: N-(phenylmethyl)-4-(1H-pyrrolo[2,3-b]pyridin-3-yl)-2-pyrimidinamine IUPAC Name: N-benzyl-4-(1H-pyrrolo[2,3-b]pyridin-3-yl)pyrimidin-2-amine Traditional Name: benzyl-[4-(1H-pyrrolo[2,3-b]pyridin-3-yl)pyrimidin-2-yl]amine Formula: C18H15N5 MolecularWeight: 301.3452

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=NC=CC(=N2)C3=CNC4=C3C=CC=N4

Isomeric SMILES

C1=CC=C(C=C1)CNC2=NC=CC(=N2)C3=CNC4=C3C=CC=N4

InChI

InChI=1S/C18H15N5/c1-2-5-13(6-3-1)11-22-18-20-10-8-16(23-18)15-12-21-17-14(15)7-4-9-19-17/h1-10,12H,11H2,(H,19,21)(H,20,22,23)