2-chloranyl-N-[[(2R)-1-(7H-purin-6-yl)pyrrolidin-2-yl]methyl]aniline

Systemtic Name: 2-chloranyl-N-[[(2R)-1-(7H-purin-6-yl)pyrrolidin-2-yl]methyl]aniline Openeye Name: 2-chloro-N-[[(2R)-1-(7H-purin-6-yl)pyrrolidin-2-yl]methyl]aniline CAS Name: 2-chloro-N-[[(2R)-1-(7H-purin-6-yl)-2-pyrrolidinyl]methyl]aniline IUPAC Name: 2-chloro-N-[[(2R)-1-(7H-purin-6-yl)pyrrolidin-2-yl]methyl]aniline Traditional Name: (2-chlorophenyl)-[[(2R)-1-(7H-purin-6-yl)pyrrolidin-2-yl]methyl]amine Formula: C16H17ClN6 MolecularWeight: 328.79938

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C2=NC=NC3=C2NC=N3)CNC4=CC=CC=C4Cl

Isomeric SMILES

C1C[C@@H](N(C1)C2=NC=NC3=C2NC=N3)CNC4=CC=CC=C4Cl

InChI

InChI=1S/C16H17ClN6/c17-12-5-1-2-6-13(12)18-8-11-4-3-7-23(11)16-14-15(20-9-19-14)21-10-22-16/h1-2,5-6,9-11,18H,3-4,7-8H2,(H,19,20,21,22)/t11-/m1/s1