4-[2-[2-(5-tert-butyl-2-methyl-pyrazol-3-yl)carbonylpyrazolidin-1-yl]-2-oxidanylidene-ethyl]-6-ethylsulfonyl-1,4-benzoxazin-3-one

Systemtic Name: 4-[2-[2-(5-tert-butyl-2-methyl-pyrazol-3-yl)carbonylpyrazolidin-1-yl]-2-oxidanylidene-ethyl]-6-ethylsulfonyl-1,4-benzoxazin-3-one Openeye Name: 4-[2-[2-(5-tert-butyl-2-methyl-pyrazole-3-carbonyl)pyrazolidin-1-yl]-2-oxo-ethyl]-6-ethylsulfonyl-1,4-benzoxazin-3-one CAS Name: 4-[2-[2-[(5-tert-butyl-2-methyl-3-pyrazolyl)-oxomethyl]-1-pyrazolidinyl]-2-oxoethyl]-6-ethylsulfonyl-1,4-benzoxazin-3-one IUPAC Name: 4-[2-[2-(5-tert-butyl-2-methylpyrazole-3-carbonyl)pyrazolidin-1-yl]-2-oxoethyl]-6-ethylsulfonyl-1,4-benzoxazin-3-one Traditional Name: 4-[2-[2-(5-tert-butyl-2-methyl-pyrazole-3-carbonyl)pyrazolidin-1-yl]-2-keto-ethyl]-6-esyl-1,4-benzoxazin-3-one Formula: C24H31N5O6S MolecularWeight: 517.59784

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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=CC(=NN4C)C(C)(C)C

Isomeric SMILES

CCS(=O)(=O)C1=CC2=C(C=C1)OCC(=O)N2CC(=O)N3CCCN3C(=O)C4=CC(=NN4C)C(C)(C)C

InChI

InChI=1S/C24H31N5O6S/c1-6-36(33,34)16-8-9-19-17(12-16)27(22(31)15-35-19)14-21(30)28-10-7-11-29(28)23(32)18-13-20(24(2,3)4)25-26(18)5/h8-9,12-13H,6-7,10-11,14-15H2,1-5H3