N1-[2-chloranyl-9-(phenylmethyl)purin-6-yl]-N4,N4-dimethyl-benzene-1,4-diamine

Systemtic Name: N1-[2-chloranyl-9-(phenylmethyl)purin-6-yl]-N4,N4-dimethyl-benzene-1,4-diamine Openeye Name: N1-(9-benzyl-2-chloro-purin-6-yl)-N4,N4-dimethyl-benzene-1,4-diamine CAS Name: N1-[2-chloro-9-(phenylmethyl)-6-purinyl]-N4,N4-dimethylbenzene-1,4-diamine IUPAC Name: 1-N-(9-benzyl-2-chloropurin-6-yl)-4-N,4-N-dimethylbenzene-1,4-diamine Traditional Name: [4-[(9-benzyl-2-chloro-purin-6-yl)amino]phenyl]-dimethyl-amine Formula: C20H19ClN6 MolecularWeight: 378.85806

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)NC2=NC(=NC3=C2N=CN3CC4=CC=CC=C4)Cl

Isomeric SMILES

CN(C)C1=CC=C(C=C1)NC2=NC(=NC3=C2N=CN3CC4=CC=CC=C4)Cl

InChI

InChI=1S/C20H19ClN6/c1-26(2)16-10-8-15(9-11-16)23-18-17-19(25-20(21)24-18)27(13-22-17)12-14-6-4-3-5-7-14/h3-11,13H,12H2,1-2H3,(H,23,24,25)