1-(5-phenyl-3,4-dihydropyrazol-2-yl)-2-[(5-piperidin-1-ylsulfonyl-1,3-benzoxazol-2-yl)sulfanyl]ethanone

Systemtic Name: 1-(5-phenyl-3,4-dihydropyrazol-2-yl)-2-[(5-piperidin-1-ylsulfonyl-1,3-benzoxazol-2-yl)sulfanyl]ethanone Openeye Name: 1-(5-phenyl-3,4-dihydropyrazol-2-yl)-2-[[5-(1-piperidylsulfonyl)-1,3-benzoxazol-2-yl]sulfanyl]ethanone CAS Name: 1-(5-phenyl-3,4-dihydropyrazol-2-yl)-2-[[5-(1-piperidinylsulfonyl)-1,3-benzoxazol-2-yl]thio]ethanone IUPAC Name: 1-(5-phenyl-3,4-dihydropyrazol-2-yl)-2-[(5-piperidin-1-ylsulfonyl-1,3-benzoxazol-2-yl)sulfanyl]ethanone Traditional Name: 1-(3-phenyl-2-pyrazolin-1-yl)-2-[(5-piperidinosulfonyl-1,3-benzoxazol-2-yl)thio]ethanone Formula: C23H24N4O4S2 MolecularWeight: 484.59106

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)OC(=N3)SCC(=O)N4CCC(=N4)C5=CC=CC=C5

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)OC(=N3)SCC(=O)N4CCC(=N4)C5=CC=CC=C5

InChI

InChI=1S/C23H24N4O4S2/c28-22(27-14-11-19(25-27)17-7-3-1-4-8-17)16-32-23-24-20-15-18(9-10-21(20)31-23)33(29,30)26-12-5-2-6-13-26/h1,3-4,7-10,15H,2,5-6,11-14,16H2