1-[4-[4-[(5-pyridin-3-yl-1,2-oxazol-3-yl)carbonyl]piperazin-1-yl]sulfonylphenyl]ethanone

Systemtic Name: 1-[4-[4-[(5-pyridin-3-yl-1,2-oxazol-3-yl)carbonyl]piperazin-1-yl]sulfonylphenyl]ethanone Openeye Name: 1-[4-[4-[5-(3-pyridyl)isoxazole-3-carbonyl]piperazin-1-yl]sulfonylphenyl]ethanone CAS Name: 1-[4-[[4-[oxo-[5-(3-pyridinyl)-3-isoxazolyl]methyl]-1-piperazinyl]sulfonyl]phenyl]ethanone IUPAC Name: 1-[4-[4-(5-pyridin-3-yl-1,2-oxazole-3-carbonyl)piperazin-1-yl]sulfonylphenyl]ethanone Traditional Name: 1-[4-[4-[5-(3-pyridyl)isoxazole-3-carbonyl]piperazino]sulfonylphenyl]ethanone Formula: C21H20N4O5S MolecularWeight: 440.4723

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=NOC(=C3)C4=CN=CC=C4

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=NOC(=C3)C4=CN=CC=C4

InChI

InChI=1S/C21H20N4O5S/c1-15(26)16-4-6-18(7-5-16)31(28,29)25-11-9-24(10-12-25)21(27)19-13-20(30-23-19)17-3-2-8-22-14-17/h2-8,13-14H,9-12H2,1H3