1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-2-quinazolin-4-yloxy-ethanone

Systemtic Name: 1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-2-quinazolin-4-yloxy-ethanone Openeye Name: 1-[4-(p-tolylsulfonyl)piperazin-1-yl]-2-quinazolin-4-yloxy-ethanone CAS Name: 1-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]-2-(4-quinazolinyloxy)ethanone IUPAC Name: 1-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-2-quinazolin-4-yloxyethanone Traditional Name: 2-quinazolin-4-yloxy-1-(4-tosylpiperazino)ethanone Formula: C21H22N4O4S MolecularWeight: 426.48878

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)COC3=NC=NC4=CC=CC=C43

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)COC3=NC=NC4=CC=CC=C43

InChI

InChI=1S/C21H22N4O4S/c1-16-6-8-17(9-7-16)30(27,28)25-12-10-24(11-13-25)20(26)14-29-21-18-4-2-3-5-19(18)22-15-23-21/h2-9,15H,10-14H2,1H3