3-[2-(3-fluoranylbutan-2-yl)phosphinin-3-yl]sulfonyl-1-methyl-1-(4-methylpyrimidin-2-yl)urea

Systemtic Name: 3-[2-(3-fluoranylbutan-2-yl)phosphinin-3-yl]sulfonyl-1-methyl-1-(4-methylpyrimidin-2-yl)urea Openeye Name: 3-[2-(2-fluoro-1-methyl-propyl)phosphinin-3-yl]sulfonyl-1-methyl-1-(4-methylpyrimidin-2-yl)urea CAS Name: 3-[[2-(3-fluorobutan-2-yl)-3-phosphorinyl]sulfonyl]-1-methyl-1-(4-methyl-2-pyrimidinyl)urea IUPAC Name: 3-[2-(3-fluorobutan-2-yl)phosphinin-3-yl]sulfonyl-1-methyl-1-(4-methylpyrimidin-2-yl)urea Traditional Name: 3-[2-(2-fluoro-1-methyl-propyl)phosphorin-3-yl]sulfonyl-1-methyl-1-(4-methylpyrimidin-2-yl)urea Formula: C16H20FN4O3PS MolecularWeight: 398.392164

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1)N(C)C(=O)NS(=O)(=O)C2=C(P=CC=C2)C(C)C(C)F

Isomeric SMILES

CC1=NC(=NC=C1)N(C)C(=O)NS(=O)(=O)C2=C(P=CC=C2)C(C)C(C)F

InChI

InChI=1S/C16H20FN4O3PS/c1-10-7-8-18-15(19-10)21(4)16(22)20-26(23,24)13-6-5-9-25-14(13)11(2)12(3)17/h5-9,11-12H,1-4H3,(H,20,22)