2-[1-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]ethyl]-N-(3-methylphenyl)quinazolin-4-amine

Systemtic Name: 2-[1-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]ethyl]-N-(3-methylphenyl)quinazolin-4-amine Openeye Name: 2-[1-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]ethyl]-N-(m-tolyl)quinazolin-4-amine CAS Name: 2-[1-[4-(4-fluorophenyl)sulfonyl-1-piperazinyl]ethyl]-N-(3-methylphenyl)-4-quinazolinamine IUPAC Name: 2-[1-[4-(4-fluorophenyl)sulfonylpiperazin-1-yl]ethyl]-N-(3-methylphenyl)quinazolin-4-amine Traditional Name: [2-[1-[4-(4-fluorophenyl)sulfonylpiperazino]ethyl]quinazolin-4-yl]-(m-tolyl)amine Formula: C27H28FN5O2S MolecularWeight: 505.606923

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H28FN5O2S/c1-19-6-5-7-22(18-19)29-27-24-8-3-4-9-25(24)30-26(31-27)20(2)32-14-16-33(17-15-32)36(34,35)23-12-10-21(28)11-13-23/h3-13,18,20H,14-17H2,1-2H3,(H,29,30,31)