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

Systemtic Name: N-(4-methoxyphenyl)-2-[1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]ethyl]quinazolin-4-amine Openeye Name: N-(4-methoxyphenyl)-2-[1-[4-(p-tolylsulfonyl)piperazin-1-yl]ethyl]quinazolin-4-amine CAS Name: N-(4-methoxyphenyl)-2-[1-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]ethyl]-4-quinazolinamine IUPAC Name: N-(4-methoxyphenyl)-2-[1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]ethyl]quinazolin-4-amine Traditional Name: (4-methoxyphenyl)-[2-[1-(4-tosylpiperazino)ethyl]quinazolin-4-yl]amine Formula: C28H31N5O3S MolecularWeight: 517.64244

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(C)C3=NC4=CC=CC=C4C(=N3)NC5=CC=C(C=C5)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(C)C3=NC4=CC=CC=C4C(=N3)NC5=CC=C(C=C5)OC

InChI

InChI=1S/C28H31N5O3S/c1-20-8-14-24(15-9-20)37(34,35)33-18-16-32(17-19-33)21(2)27-30-26-7-5-4-6-25(26)28(31-27)29-22-10-12-23(36-3)13-11-22/h4-15,21H,16-19H2,1-3H3,(H,29,30,31)