N-(4-piperazin-1-ylphenyl)-4-(1-propylpyrrolo[2,3-b]pyridin-3-yl)pyrimidin-2-amine

Systemtic Name: N-(4-piperazin-1-ylphenyl)-4-(1-propylpyrrolo[2,3-b]pyridin-3-yl)pyrimidin-2-amine Openeye Name: N-(4-piperazin-1-ylphenyl)-4-(1-propylpyrrolo[2,3-b]pyridin-3-yl)pyrimidin-2-amine CAS Name: N-[4-(1-piperazinyl)phenyl]-4-(1-propyl-3-pyrrolo[2,3-b]pyridinyl)-2-pyrimidinamine IUPAC Name: N-(4-piperazin-1-ylphenyl)-4-(1-propylpyrrolo[2,3-b]pyridin-3-yl)pyrimidin-2-amine Traditional Name: (4-piperazinophenyl)-[4-(1-propylpyrrolo[2,3-b]pyridin-3-yl)pyrimidin-2-yl]amine Formula: C24H27N7 MolecularWeight: 413.51808

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=C(C2=C1N=CC=C2)C3=NC(=NC=C3)NC4=CC=C(C=C4)N5CCNCC5

Isomeric SMILES

CCCN1C=C(C2=C1N=CC=C2)C3=NC(=NC=C3)NC4=CC=C(C=C4)N5CCNCC5

InChI

InChI=1S/C24H27N7/c1-2-14-31-17-21(20-4-3-10-26-23(20)31)22-9-11-27-24(29-22)28-18-5-7-19(8-6-18)30-15-12-25-13-16-30/h3-11,17,25H,2,12-16H2,1H3,(H,27,28,29)