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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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