(4R,5S)-2-chloranyl-9-(phenylmethyl)-4,5-dihydropurin-6-amine

Systemtic Name: (4R,5S)-2-chloranyl-9-(phenylmethyl)-4,5-dihydropurin-6-amine Openeye Name: (4R,5S)-9-benzyl-2-chloro-4,5-dihydropurin-6-amine CAS Name: (4R,5S)-2-chloro-9-(phenylmethyl)-4,5-dihydropurin-6-amine IUPAC Name: (4R,5S)-9-benzyl-2-chloro-4,5-dihydropurin-6-amine Traditional Name: [(4R,5S)-9-benzyl-2-chloro-4,5-dihydropurin-6-yl]amine Formula: C12H12ClN5 MolecularWeight: 261.71018

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=NC3C2N=C(N=C3N)Cl

Isomeric SMILES

C1=CC=C(C=C1)CN2C=N[C@H]3[C@H]2N=C(N=C3N)Cl

InChI

InChI=1S/C12H12ClN5/c13-12-16-10(14)9-11(17-12)18(7-15-9)6-8-4-2-1-3-5-8/h1-5,7,9,11H,6H2,(H2,14,16,17)/t9-,11+/m1/s1