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4-[2,4-bis(oxidanylidene)-1H-pyrimidin-3-yl]-N-oxidanyl-2-[(4-phenoxyphenyl)sulfonyl-prop-2-ynyl-amino]butanamide

4-[2,4-bis(oxidanylidene)-1H-pyrimidin-3-yl]-N-oxidanyl-2-[(4-phenoxyphenyl)sulfonyl-prop-2-ynyl-amino]butanamide

Systemtic Name:4-[2,4-bis(oxidanylidene)-1H-pyrimidin-3-yl]-N-oxidanyl-2-[(4-phenoxyphenyl)sulfonyl-prop-2-ynyl-amino]butanamide
Openeye Name:4-(2,4-dioxo-1H-pyrimidin-3-yl)-2-[(4-phenoxyphenyl)sulfonyl-prop-2-ynyl-amino]butanehydroxamic acid
CAS Name:4-(2,4-dioxo-1H-pyrimidin-3-yl)-N-hydroxy-2-[(4-phenoxyphenyl)sulfonyl-prop-2-ynylamino]butanamide
IUPAC Name:4-(2,4-dioxo-1H-pyrimidin-3-yl)-N-hydroxy-2-[(4-phenoxyphenyl)sulfonyl-prop-2-ynylamino]butanamide
Traditional Name:4-(2,4-diketo-1H-pyrimidin-3-yl)-2-[(4-phenoxyphenyl)sulfonyl-propargyl-amino]butanehydroxamic acid
Formula: C23H22N4O7S
MolecularWeight: 498.50838
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Descriptors Computed from Structure

Canonical SMILES:

C#CCN(C(CCN1C(=O)C=CNC1=O)C(=O)NO)S(=O)(=O)C2=CC=C(C=C2)OC3=CC=CC=C3


Isomeric SMILES

C#CCN(C(CCN1C(=O)C=CNC1=O)C(=O)NO)S(=O)(=O)C2=CC=C(C=C2)OC3=CC=CC=C3


InChI

InChI=1S/C23H22N4O7S/c1-2-15-27(20(22(29)25-31)13-16-26-21(28)12-14-24-23(26)30)35(32,33)19-10-8-18(9-11-19)34-17-6-4-3-5-7-17/h1,3-12,14,20,31H,13,15-16H2,(H,24,30)(H,25,29)


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