9-butan-2-yl-2-chloranyl-N-phenyl-purin-6-amine

Systemtic Name: 9-butan-2-yl-2-chloranyl-N-phenyl-purin-6-amine Openeye Name: 2-chloro-N-phenyl-9-sec-butyl-purin-6-amine CAS Name: 9-butan-2-yl-2-chloro-N-phenyl-6-purinamine IUPAC Name: 9-butan-2-yl-2-chloro-N-phenylpurin-6-amine Traditional Name: (2-chloro-9-sec-butyl-purin-6-yl)-phenyl-amine Formula: C15H16ClN5 MolecularWeight: 301.77404

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C=NC2=C1N=C(N=C2NC3=CC=CC=C3)Cl

Isomeric SMILES

CCC(C)N1C=NC2=C1N=C(N=C2NC3=CC=CC=C3)Cl

InChI

InChI=1S/C15H16ClN5/c1-3-10(2)21-9-17-12-13(19-15(16)20-14(12)21)18-11-7-5-4-6-8-11/h4-10H,3H2,1-2H3,(H,18,19,20)