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

Systemtic Name: 2-[1-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]ethyl]-N-(2-methylphenyl)quinazolin-4-amine Openeye Name: 2-[1-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]ethyl]-N-(o-tolyl)quinazolin-4-amine CAS Name: 2-[1-[4-(4-chlorophenyl)sulfonyl-1-piperazinyl]ethyl]-N-(2-methylphenyl)-4-quinazolinamine IUPAC Name: 2-[1-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]ethyl]-N-(2-methylphenyl)quinazolin-4-amine Traditional Name: [2-[1-[4-(4-chlorophenyl)sulfonylpiperazino]ethyl]quinazolin-4-yl]-(o-tolyl)amine Formula: C27H28ClN5O2S MolecularWeight: 522.06152

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC2=NC(=NC3=CC=CC=C32)C(C)N4CCN(CC4)S(=O)(=O)C5=CC=C(C=C5)Cl

Isomeric SMILES

CC1=CC=CC=C1NC2=NC(=NC3=CC=CC=C32)C(C)N4CCN(CC4)S(=O)(=O)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C27H28ClN5O2S/c1-19-7-3-5-9-24(19)29-27-23-8-4-6-10-25(23)30-26(31-27)20(2)32-15-17-33(18-16-32)36(34,35)22-13-11-21(28)12-14-22/h3-14,20H,15-18H2,1-2H3,(H,29,30,31)