5-[2-chloranyl-6-[(phenylmethyl)amino]-7H-purin-8-yl]-2-(hydroxymethyl)oxolan-3-ol

Systemtic Name: 5-[2-chloranyl-6-[(phenylmethyl)amino]-7H-purin-8-yl]-2-(hydroxymethyl)oxolan-3-ol Openeye Name: 5-[6-(benzylamino)-2-chloro-7H-purin-8-yl]-2-(hydroxymethyl)tetrahydrofuran-3-ol CAS Name: 5-[2-chloro-6-[(phenylmethyl)amino]-7H-purin-8-yl]-2-(hydroxymethyl)-3-oxolanol IUPAC Name: 5-[6-(benzylamino)-2-chloro-7H-purin-8-yl]-2-(hydroxymethyl)oxolan-3-ol Traditional Name: 5-[6-(benzylamino)-2-chloro-7H-purin-8-yl]-2-methylol-tetrahydrofuran-3-ol Formula: C17H18ClN5O3 MolecularWeight: 375.80952

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(OC1C2=NC3=C(N2)C(=NC(=N3)Cl)NCC4=CC=CC=C4)CO)O

Isomeric SMILES

C1C(C(OC1C2=NC3=C(N2)C(=NC(=N3)Cl)NCC4=CC=CC=C4)CO)O

InChI

InChI=1S/C17H18ClN5O3/c18-17-22-15(19-7-9-4-2-1-3-5-9)13-16(23-17)21-14(20-13)11-6-10(25)12(8-24)26-11/h1-5,10-12,24-25H,6-8H2,(H2,19,20,21,22,23)