2-[1-[4-(4-ethylphenyl)sulfonylpiperazin-1-yl]ethyl]-N-(4-methylphenyl)quinazolin-4-amine

Systemtic Name: 2-[1-[4-(4-ethylphenyl)sulfonylpiperazin-1-yl]ethyl]-N-(4-methylphenyl)quinazolin-4-amine Openeye Name: 2-[1-[4-(4-ethylphenyl)sulfonylpiperazin-1-yl]ethyl]-N-(p-tolyl)quinazolin-4-amine CAS Name: 2-[1-[4-(4-ethylphenyl)sulfonyl-1-piperazinyl]ethyl]-N-(4-methylphenyl)-4-quinazolinamine IUPAC Name: 2-[1-[4-(4-ethylphenyl)sulfonylpiperazin-1-yl]ethyl]-N-(4-methylphenyl)quinazolin-4-amine Traditional Name: [2-[1-[4-(4-ethylphenyl)sulfonylpiperazino]ethyl]quinazolin-4-yl]-(p-tolyl)amine Formula: C29H33N5O2S MolecularWeight: 515.66962

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(C)C3=NC4=CC=CC=C4C(=N3)NC5=CC=C(C=C5)C

Isomeric SMILES

CCC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(C)C3=NC4=CC=CC=C4C(=N3)NC5=CC=C(C=C5)C

InChI

InChI=1S/C29H33N5O2S/c1-4-23-11-15-25(16-12-23)37(35,36)34-19-17-33(18-20-34)22(3)28-31-27-8-6-5-7-26(27)29(32-28)30-24-13-9-21(2)10-14-24/h5-16,22H,4,17-20H2,1-3H3,(H,30,31,32)