6-ethylsulfonyl-4-[2-oxidanylidene-2-[2-(1-phenylcyclopropyl)carbonylpyrazolidin-1-yl]ethyl]-1,4-benzoxazin-3-one

Systemtic Name: 6-ethylsulfonyl-4-[2-oxidanylidene-2-[2-(1-phenylcyclopropyl)carbonylpyrazolidin-1-yl]ethyl]-1,4-benzoxazin-3-one Openeye Name: 6-ethylsulfonyl-4-[2-oxo-2-[2-(1-phenylcyclopropanecarbonyl)pyrazolidin-1-yl]ethyl]-1,4-benzoxazin-3-one CAS Name: 6-ethylsulfonyl-4-[2-oxo-2-[2-[oxo-(1-phenylcyclopropyl)methyl]-1-pyrazolidinyl]ethyl]-1,4-benzoxazin-3-one IUPAC Name: 6-ethylsulfonyl-4-[2-oxo-2-[2-(1-phenylcyclopropanecarbonyl)pyrazolidin-1-yl]ethyl]-1,4-benzoxazin-3-one Traditional Name: 6-esyl-4-[2-keto-2-[2-(1-phenylcyclopropanecarbonyl)pyrazolidin-1-yl]ethyl]-1,4-benzoxazin-3-one Formula: C25H27N3O6S MolecularWeight: 497.56338

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC2=C(C=C1)OCC(=O)N2CC(=O)N3CCCN3C(=O)C4(CC4)C5=CC=CC=C5

Isomeric SMILES

CCS(=O)(=O)C1=CC2=C(C=C1)OCC(=O)N2CC(=O)N3CCCN3C(=O)C4(CC4)C5=CC=CC=C5

InChI

InChI=1S/C25H27N3O6S/c1-2-35(32,33)19-9-10-21-20(15-19)26(23(30)17-34-21)16-22(29)27-13-6-14-28(27)24(31)25(11-12-25)18-7-4-3-5-8-18/h3-5,7-10,15H,2,6,11-14,16-17H2,1H3