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

Systemtic Name: N-(2,6-dimethylphenyl)-2-[1-[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-yl]ethyl]quinazolin-4-amine Openeye Name: N-(2,6-dimethylphenyl)-2-[1-[4-(4-isopropylphenyl)sulfonylpiperazin-1-yl]ethyl]quinazolin-4-amine CAS Name: N-(2,6-dimethylphenyl)-2-[1-[4-(4-propan-2-ylphenyl)sulfonyl-1-piperazinyl]ethyl]-4-quinazolinamine IUPAC Name: N-(2,6-dimethylphenyl)-2-[1-[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-yl]ethyl]quinazolin-4-amine Traditional Name: (2,6-dimethylphenyl)-[2-[1-(4-p-cumenylsulfonylpiperazino)ethyl]quinazolin-4-yl]amine Formula: C31H37N5O2S MolecularWeight: 543.72278

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C31H37N5O2S/c1-21(2)25-13-15-26(16-14-25)39(37,38)36-19-17-35(18-20-36)24(5)30-32-28-12-7-6-11-27(28)31(34-30)33-29-22(3)9-8-10-23(29)4/h6-16,21,24H,17-20H2,1-5H3,(H,32,33,34)