2-[1-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]ethyl]-N-phenethyl-quinazolin-4-amine

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC2=CC=CC=C2C(=N1)NCCC3=CC=CC=C3)N4CCN(CC4)S(=O)(=O)C5=CC=C(C=C5)Br

Isomeric SMILES

CC(C1=NC2=CC=CC=C2C(=N1)NCCC3=CC=CC=C3)N4CCN(CC4)S(=O)(=O)C5=CC=C(C=C5)Br

InChI

InChI=1S/C28H30BrN5O2S/c1-21(33-17-19-34(20-18-33)37(35,36)24-13-11-23(29)12-14-24)27-31-26-10-6-5-9-25(26)28(32-27)30-16-15-22-7-3-2-4-8-22/h2-14,21H,15-20H2,1H3,(H,30,31,32)