1-(4-methoxy-6-methyl-pyrimidin-2-yl)-3-[[3-oxidanylidene-6-(trifluoromethyl)-4H-1,4-benzothiazin-8-yl]sulfonyl]urea

Systemtic Name: 1-(4-methoxy-6-methyl-pyrimidin-2-yl)-3-[[3-oxidanylidene-6-(trifluoromethyl)-4H-1,4-benzothiazin-8-yl]sulfonyl]urea Openeye Name: 1-(4-methoxy-6-methyl-pyrimidin-2-yl)-3-[[3-oxo-6-(trifluoromethyl)-4H-1,4-benzothiazin-8-yl]sulfonyl]urea CAS Name: 1-(4-methoxy-6-methyl-2-pyrimidinyl)-3-[[3-oxo-6-(trifluoromethyl)-4H-1,4-benzothiazin-8-yl]sulfonyl]urea IUPAC Name: 1-(4-methoxy-6-methylpyrimidin-2-yl)-3-[[3-oxo-6-(trifluoromethyl)-4H-1,4-benzothiazin-8-yl]sulfonyl]urea Traditional Name: 1-[[3-keto-6-(trifluoromethyl)-4H-1,4-benzothiazin-8-yl]sulfonyl]-3-(4-methoxy-6-methyl-pyrimidin-2-yl)urea Formula: C16H14F3N5O5S2 MolecularWeight: 477.43807

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NC(=O)NS(=O)(=O)C2=CC(=CC3=C2SCC(=O)N3)C(F)(F)F)OC

Isomeric SMILES

CC1=CC(=NC(=N1)NC(=O)NS(=O)(=O)C2=CC(=CC3=C2SCC(=O)N3)C(F)(F)F)OC

InChI

InChI=1S/C16H14F3N5O5S2/c1-7-3-12(29-2)22-14(20-7)23-15(26)24-31(27,28)10-5-8(16(17,18)19)4-9-13(10)30-6-11(25)21-9/h3-5H,6H2,1-2H3,(H,21,25)(H2,20,22,23,24,26)