2-chloranyl-N-[(4-phenylphenyl)methyl]-9-prop-2-enyl-purin-6-amine

Systemtic Name: 2-chloranyl-N-[(4-phenylphenyl)methyl]-9-prop-2-enyl-purin-6-amine Openeye Name: 9-allyl-2-chloro-N-[(4-phenylphenyl)methyl]purin-6-amine CAS Name: 2-chloro-N-[(4-phenylphenyl)methyl]-9-prop-2-enyl-6-purinamine IUPAC Name: 2-chloro-N-[(4-phenylphenyl)methyl]-9-prop-2-enylpurin-6-amine Traditional Name: (9-allyl-2-chloro-purin-6-yl)-(4-phenylbenzyl)amine Formula: C21H18ClN5 MolecularWeight: 375.85412

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C=NC2=C1N=C(N=C2NCC3=CC=C(C=C3)C4=CC=CC=C4)Cl

Isomeric SMILES

C=CCN1C=NC2=C1N=C(N=C2NCC3=CC=C(C=C3)C4=CC=CC=C4)Cl

InChI

InChI=1S/C21H18ClN5/c1-2-12-27-14-24-18-19(25-21(22)26-20(18)27)23-13-15-8-10-17(11-9-15)16-6-4-3-5-7-16/h2-11,14H,1,12-13H2,(H,23,25,26)