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

Systemtic Name: 6-ethylsulfonyl-4-[2-[2-(4-methoxyquinolin-2-yl)carbonylpyrazolidin-1-yl]-2-oxidanylidene-ethyl]-1,4-benzoxazin-3-one Openeye Name: 6-ethylsulfonyl-4-[2-[2-(4-methoxyquinoline-2-carbonyl)pyrazolidin-1-yl]-2-oxo-ethyl]-1,4-benzoxazin-3-one CAS Name: 6-ethylsulfonyl-4-[2-[2-[(4-methoxy-2-quinolinyl)-oxomethyl]-1-pyrazolidinyl]-2-oxoethyl]-1,4-benzoxazin-3-one IUPAC Name: 6-ethylsulfonyl-4-[2-[2-(4-methoxyquinoline-2-carbonyl)pyrazolidin-1-yl]-2-oxoethyl]-1,4-benzoxazin-3-one Traditional Name: 6-esyl-4-[2-keto-2-[2-(4-methoxyquinoline-2-carbonyl)pyrazolidin-1-yl]ethyl]-1,4-benzoxazin-3-one Formula: C26H26N4O7S MolecularWeight: 538.57224

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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=NC5=CC=CC=C5C(=C4)OC

Isomeric SMILES

CCS(=O)(=O)C1=CC2=C(C=C1)OCC(=O)N2CC(=O)N3CCCN3C(=O)C4=NC5=CC=CC=C5C(=C4)OC

InChI

InChI=1S/C26H26N4O7S/c1-3-38(34,35)17-9-10-22-21(13-17)28(25(32)16-37-22)15-24(31)29-11-6-12-30(29)26(33)20-14-23(36-2)18-7-4-5-8-19(18)27-20/h4-5,7-10,13-14H,3,6,11-12,15-16H2,1-2H3