2-[1-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]ethyl]-N-(2,6-dimethylphenyl)quinazolin-4-amine

Systemtic Name: 2-[1-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]ethyl]-N-(2,6-dimethylphenyl)quinazolin-4-amine Openeye Name: 2-[1-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]ethyl]-N-(2,6-dimethylphenyl)quinazolin-4-amine CAS Name: 2-[1-[4-(4-bromophenyl)sulfonyl-1-piperazinyl]ethyl]-N-(2,6-dimethylphenyl)-4-quinazolinamine IUPAC Name: 2-[1-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]ethyl]-N-(2,6-dimethylphenyl)quinazolin-4-amine Traditional Name: [2-[1-(4-brosylpiperazino)ethyl]quinazolin-4-yl]-(2,6-dimethylphenyl)amine Formula: C28H30BrN5O2S MolecularWeight: 580.5391

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC2=NC(=NC3=CC=CC=C32)C(C)N4CCN(CC4)S(=O)(=O)C5=CC=C(C=C5)Br

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC2=NC(=NC3=CC=CC=C32)C(C)N4CCN(CC4)S(=O)(=O)C5=CC=C(C=C5)Br

InChI

InChI=1S/C28H30BrN5O2S/c1-19-7-6-8-20(2)26(19)31-28-24-9-4-5-10-25(24)30-27(32-28)21(3)33-15-17-34(18-16-33)37(35,36)23-13-11-22(29)12-14-23/h4-14,21H,15-18H2,1-3H3,(H,30,31,32)