6-(2,6-dimethylphenyl)-N-(4-piperazin-1-ylphenyl)quinazolin-2-amine

Systemtic Name: 6-(2,6-dimethylphenyl)-N-(4-piperazin-1-ylphenyl)quinazolin-2-amine Openeye Name: 6-(2,6-dimethylphenyl)-N-(4-piperazin-1-ylphenyl)quinazolin-2-amine CAS Name: 6-(2,6-dimethylphenyl)-N-[4-(1-piperazinyl)phenyl]-2-quinazolinamine IUPAC Name: 6-(2,6-dimethylphenyl)-N-(4-piperazin-1-ylphenyl)quinazolin-2-amine Traditional Name: [6-(2,6-dimethylphenyl)quinazolin-2-yl]-(4-piperazinophenyl)amine Formula: C26H27N5 MolecularWeight: 409.52608

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)C2=CC3=CN=C(N=C3C=C2)NC4=CC=C(C=C4)N5CCNCC5

Isomeric SMILES

CC1=C(C(=CC=C1)C)C2=CC3=CN=C(N=C3C=C2)NC4=CC=C(C=C4)N5CCNCC5

InChI

InChI=1S/C26H27N5/c1-18-4-3-5-19(2)25(18)20-6-11-24-21(16-20)17-28-26(30-24)29-22-7-9-23(10-8-22)31-14-12-27-13-15-31/h3-11,16-17,27H,12-15H2,1-2H3,(H,28,29,30)