1-[6-[(3-chlorophenyl)amino]-9-ethyl-purin-2-yl]piperidin-4-ol

Systemtic Name: 1-[6-[(3-chlorophenyl)amino]-9-ethyl-purin-2-yl]piperidin-4-ol Openeye Name: 1-[6-(3-chloroanilino)-9-ethyl-purin-2-yl]piperidin-4-ol CAS Name: 1-[6-(3-chloroanilino)-9-ethyl-2-purinyl]-4-piperidinol IUPAC Name: 1-[6-(3-chloroanilino)-9-ethylpurin-2-yl]piperidin-4-ol Traditional Name: 1-[6-(3-chloroanilino)-9-ethyl-purin-2-yl]piperidin-4-ol Formula: C18H21ClN6O MolecularWeight: 372.85194

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=NC2=C1N=C(N=C2NC3=CC(=CC=C3)Cl)N4CCC(CC4)O

Isomeric SMILES

CCN1C=NC2=C1N=C(N=C2NC3=CC(=CC=C3)Cl)N4CCC(CC4)O

InChI

InChI=1S/C18H21ClN6O/c1-2-24-11-20-15-16(21-13-5-3-4-12(19)10-13)22-18(23-17(15)24)25-8-6-14(26)7-9-25/h3-5,10-11,14,26H,2,6-9H2,1H3,(H,21,22,23)