1-[2-(azetidin-1-ylsulfonyl)phenyl]sulfonyl-3-(4-methoxy-6-methyl-pyrimidin-2-yl)urea

Systemtic Name: 1-[2-(azetidin-1-ylsulfonyl)phenyl]sulfonyl-3-(4-methoxy-6-methyl-pyrimidin-2-yl)urea Openeye Name: 1-[2-(azetidin-1-ylsulfonyl)phenyl]sulfonyl-3-(4-methoxy-6-methyl-pyrimidin-2-yl)urea CAS Name: 1-[2-(1-azetidinylsulfonyl)phenyl]sulfonyl-3-(4-methoxy-6-methyl-2-pyrimidinyl)urea IUPAC Name: 1-[2-(azetidin-1-ylsulfonyl)phenyl]sulfonyl-3-(4-methoxy-6-methylpyrimidin-2-yl)urea Traditional Name: 1-[2-(azetidin-1-ylsulfonyl)phenyl]sulfonyl-3-(4-methoxy-6-methyl-pyrimidin-2-yl)urea Formula: C16H19N5O6S2 MolecularWeight: 441.48196

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NC(=O)NS(=O)(=O)C2=CC=CC=C2S(=O)(=O)N3CCC3)OC

Isomeric SMILES

CC1=CC(=NC(=N1)NC(=O)NS(=O)(=O)C2=CC=CC=C2S(=O)(=O)N3CCC3)OC

InChI

InChI=1S/C16H19N5O6S2/c1-11-10-14(27-2)18-15(17-11)19-16(22)20-28(23,24)12-6-3-4-7-13(12)29(25,26)21-8-5-9-21/h3-4,6-7,10H,5,8-9H2,1-2H3,(H2,17,18,19,20,22)