N-(3-chloranyl-4-methoxy-phenyl)-9-phenyl-purin-6-amine

Systemtic Name: N-(3-chloranyl-4-methoxy-phenyl)-9-phenyl-purin-6-amine Openeye Name: N-(3-chloro-4-methoxy-phenyl)-9-phenyl-purin-6-amine CAS Name: N-(3-chloro-4-methoxyphenyl)-9-phenyl-6-purinamine IUPAC Name: N-(3-chloro-4-methoxyphenyl)-9-phenylpurin-6-amine Traditional Name: (3-chloro-4-methoxy-phenyl)-(9-phenylpurin-6-yl)amine Formula: C18H14ClN5O MolecularWeight: 351.78966

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC2=NC=NC3=C2N=CN3C4=CC=CC=C4)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)NC2=NC=NC3=C2N=CN3C4=CC=CC=C4)Cl

InChI

InChI=1S/C18H14ClN5O/c1-25-15-8-7-12(9-14(15)19)23-17-16-18(21-10-20-17)24(11-22-16)13-5-3-2-4-6-13/h2-11H,1H3,(H,20,21,23)