1-[4-(4-quinazolin-4-ylpiperazin-1-yl)sulfonylphenyl]ethanone

Systemtic Name: 1-[4-(4-quinazolin-4-ylpiperazin-1-yl)sulfonylphenyl]ethanone Openeye Name: 1-[4-(4-quinazolin-4-ylpiperazin-1-yl)sulfonylphenyl]ethanone CAS Name: 1-[4-[[4-(4-quinazolinyl)-1-piperazinyl]sulfonyl]phenyl]ethanone IUPAC Name: 1-[4-(4-quinazolin-4-ylpiperazin-1-yl)sulfonylphenyl]ethanone Traditional Name: 1-[4-(4-quinazolin-4-ylpiperazino)sulfonylphenyl]ethanone Formula: C20H20N4O3S MolecularWeight: 396.4628

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=NC=NC4=CC=CC=C43

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=NC=NC4=CC=CC=C43

InChI

InChI=1S/C20H20N4O3S/c1-15(25)16-6-8-17(9-7-16)28(26,27)24-12-10-23(11-13-24)20-18-4-2-3-5-19(18)21-14-22-20/h2-9,14H,10-13H2,1H3