9-cyclopropyl-N-[4-(methylaminomethyl)phenyl]-8-pyridin-4-yl-purin-2-amine

Systemtic Name: 9-cyclopropyl-N-[4-(methylaminomethyl)phenyl]-8-pyridin-4-yl-purin-2-amine Openeye Name: 9-cyclopropyl-N-[4-(methylaminomethyl)phenyl]-8-(4-pyridyl)purin-2-amine CAS Name: 9-cyclopropyl-N-[4-(methylaminomethyl)phenyl]-8-pyridin-4-yl-2-purinamine IUPAC Name: 9-cyclopropyl-N-[4-(methylaminomethyl)phenyl]-8-pyridin-4-ylpurin-2-amine Traditional Name: [9-cyclopropyl-8-(4-pyridyl)purin-2-yl]-[4-(methylaminomethyl)phenyl]amine Formula: C21H21N7 MolecularWeight: 371.43834

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Descriptors Computed from Structure

Canonical SMILES:

CNCC1=CC=C(C=C1)NC2=NC=C3C(=N2)N(C(=N3)C4=CC=NC=C4)C5CC5

Isomeric SMILES

CNCC1=CC=C(C=C1)NC2=NC=C3C(=N2)N(C(=N3)C4=CC=NC=C4)C5CC5

InChI

InChI=1S/C21H21N7/c1-22-12-14-2-4-16(5-3-14)25-21-24-13-18-20(27-21)28(17-6-7-17)19(26-18)15-8-10-23-11-9-15/h2-5,8-11,13,17,22H,6-7,12H2,1H3,(H,24,25,27)