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

Systemtic Name: 2-[[6-[(3-chlorophenyl)amino]-9-ethyl-purin-2-yl]-oxidanyl-amino]propan-1-ol Openeye Name: 2-[[6-(3-chloroanilino)-9-ethyl-purin-2-yl]-hydroxy-amino]propan-1-ol CAS Name: 2-[[6-(3-chloroanilino)-9-ethyl-2-purinyl]-hydroxyamino]-1-propanol IUPAC Name: 2-[[6-(3-chloroanilino)-9-ethylpurin-2-yl]-hydroxyamino]propan-1-ol Traditional Name: 2-[[6-(3-chloroanilino)-9-ethyl-purin-2-yl]-hydroxy-amino]propan-1-ol Formula: C16H19ClN6O2 MolecularWeight: 362.81406

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H19ClN6O2/c1-3-22-9-18-13-14(19-12-6-4-5-11(17)7-12)20-16(21-15(13)22)23(25)10(2)8-24/h4-7,9-10,24-25H,3,8H2,1-2H3,(H,19,20,21)