6-(azepan-1-yl)-9-[[2,6-bis(chloranyl)phenyl]methyl]purine

Systemtic Name: 6-(azepan-1-yl)-9-[[2,6-bis(chloranyl)phenyl]methyl]purine Openeye Name: 6-(azepan-1-yl)-9-[(2,6-dichlorophenyl)methyl]purine CAS Name: 6-(1-azepanyl)-9-[(2,6-dichlorophenyl)methyl]purine IUPAC Name: 6-(azepan-1-yl)-9-[(2,6-dichlorophenyl)methyl]purine Traditional Name: 6-(azepan-1-yl)-9-(2,6-dichlorobenzyl)purine Formula: C18H19Cl2N5 MolecularWeight: 376.28296

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=NC=NC3=C2N=CN3CC4=C(C=CC=C4Cl)Cl

Isomeric SMILES

C1CCCN(CC1)C2=NC=NC3=C2N=CN3CC4=C(C=CC=C4Cl)Cl

InChI

InChI=1S/C18H19Cl2N5/c19-14-6-5-7-15(20)13(14)10-25-12-23-16-17(21-11-22-18(16)25)24-8-3-1-2-4-9-24/h5-7,11-12H,1-4,8-10H2