2-chloranyl-N-[4-(phenylmethyl)piperidin-1-yl]-9-propan-2-yl-purin-6-amine

Systemtic Name: 2-chloranyl-N-[4-(phenylmethyl)piperidin-1-yl]-9-propan-2-yl-purin-6-amine Openeye Name: N-(4-benzyl-1-piperidyl)-2-chloro-9-isopropyl-purin-6-amine CAS Name: 2-chloro-N-[4-(phenylmethyl)-1-piperidinyl]-9-propan-2-yl-6-purinamine IUPAC Name: N-(4-benzylpiperidin-1-yl)-2-chloro-9-propan-2-ylpurin-6-amine Traditional Name: (4-benzylpiperidino)-(2-chloro-9-isopropyl-purin-6-yl)amine Formula: C20H25ClN6 MolecularWeight: 384.9057

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=NC2=C1N=C(N=C2NN3CCC(CC3)CC4=CC=CC=C4)Cl

Isomeric SMILES

CC(C)N1C=NC2=C1N=C(N=C2NN3CCC(CC3)CC4=CC=CC=C4)Cl

InChI

InChI=1S/C20H25ClN6/c1-14(2)27-13-22-17-18(23-20(21)24-19(17)27)25-26-10-8-16(9-11-26)12-15-6-4-3-5-7-15/h3-7,13-14,16H,8-12H2,1-2H3,(H,23,24,25)