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

Systemtic Name: N-(2,6-dimethylphenyl)-2-[1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]ethyl]quinazolin-4-amine Openeye Name: N-(2,6-dimethylphenyl)-2-[1-[4-(p-tolylsulfonyl)piperazin-1-yl]ethyl]quinazolin-4-amine CAS Name: N-(2,6-dimethylphenyl)-2-[1-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]ethyl]-4-quinazolinamine IUPAC Name: N-(2,6-dimethylphenyl)-2-[1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]ethyl]quinazolin-4-amine Traditional Name: (2,6-dimethylphenyl)-[2-[1-(4-tosylpiperazino)ethyl]quinazolin-4-yl]amine Formula: C29H33N5O2S MolecularWeight: 515.66962

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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=C(C=CC=C5C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(C)C3=NC4=CC=CC=C4C(=N3)NC5=C(C=CC=C5C)C

InChI

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