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

Systemtic Name: 1-[[6-[(3-chlorophenyl)amino]-9-ethyl-purin-2-yl]amino]propan-2-ol Openeye Name: 1-[[6-(3-chloroanilino)-9-ethyl-purin-2-yl]amino]propan-2-ol CAS Name: 1-[[6-(3-chloroanilino)-9-ethyl-2-purinyl]amino]-2-propanol IUPAC Name: 1-[[6-(3-chloroanilino)-9-ethylpurin-2-yl]amino]propan-2-ol Traditional Name: 1-[[6-(3-chloroanilino)-9-ethyl-purin-2-yl]amino]propan-2-ol Formula: C16H19ClN6O MolecularWeight: 346.81466

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H19ClN6O/c1-3-23-9-19-13-14(20-12-6-4-5-11(17)7-12)21-16(22-15(13)23)18-8-10(2)24/h4-7,9-10,24H,3,8H2,1-2H3,(H2,18,20,21,22)