2-[(2-chloranyl-5-fluoranyl-phenyl)amino]-7-(cyclopentylmethyl)-9-methyl-purin-8-one

Systemtic Name: 2-[(2-chloranyl-5-fluoranyl-phenyl)amino]-7-(cyclopentylmethyl)-9-methyl-purin-8-one Openeye Name: 2-(2-chloro-5-fluoro-anilino)-7-(cyclopentylmethyl)-9-methyl-purin-8-one CAS Name: 2-(2-chloro-5-fluoroanilino)-7-(cyclopentylmethyl)-9-methyl-8-purinone IUPAC Name: 2-(2-chloro-5-fluoroanilino)-7-(cyclopentylmethyl)-9-methylpurin-8-one Traditional Name: 2-(2-chloro-5-fluoro-anilino)-7-(cyclopentylmethyl)-9-methyl-purin-8-one Formula: C18H19ClFN5O MolecularWeight: 375.827763

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=NC(=NC=C2N(C1=O)CC3CCCC3)NC4=C(C=CC(=C4)F)Cl

Isomeric SMILES

CN1C2=NC(=NC=C2N(C1=O)CC3CCCC3)NC4=C(C=CC(=C4)F)Cl

InChI

InChI=1S/C18H19ClFN5O/c1-24-16-15(25(18(24)26)10-11-4-2-3-5-11)9-21-17(23-16)22-14-8-12(20)6-7-13(14)19/h6-9,11H,2-5,10H2,1H3,(H,21,22,23)