2-chloranyl-9-cyclopentyl-N-[(1R)-1-phenylethyl]purin-6-amine

Systemtic Name: 2-chloranyl-9-cyclopentyl-N-[(1R)-1-phenylethyl]purin-6-amine Openeye Name: 2-chloro-9-cyclopentyl-N-[(1R)-1-phenylethyl]purin-6-amine CAS Name: 2-chloro-9-cyclopentyl-N-[(1R)-1-phenylethyl]-6-purinamine IUPAC Name: 2-chloro-9-cyclopentyl-N-[(1R)-1-phenylethyl]purin-6-amine Traditional Name: (2-chloro-9-cyclopentyl-purin-6-yl)-[(1R)-1-phenylethyl]amine Formula: C18H20ClN5 MolecularWeight: 341.8379

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC2=NC(=NC3=C2N=CN3C4CCCC4)Cl

Isomeric SMILES

C[C@H](C1=CC=CC=C1)NC2=NC(=NC3=C2N=CN3C4CCCC4)Cl

InChI

InChI=1S/C18H20ClN5/c1-12(13-7-3-2-4-8-13)21-16-15-17(23-18(19)22-16)24(11-20-15)14-9-5-6-10-14/h2-4,7-8,11-12,14H,5-6,9-10H2,1H3,(H,21,22,23)/t12-/m1/s1