(1E)-1-(6-methylsulfonyl-1-oxidanyl-pyridazin-4-ylidene)-3-propan-2-yl-urea

Systemtic Name: (1E)-1-(6-methylsulfonyl-1-oxidanyl-pyridazin-4-ylidene)-3-propan-2-yl-urea Openeye Name: (1E)-1-(1-hydroxy-6-methylsulfonyl-pyridazin-4-ylidene)-3-isopropyl-urea CAS Name: (1E)-1-(1-hydroxy-6-methylsulfonyl-4-pyridazinylidene)-3-propan-2-ylurea IUPAC Name: (1E)-1-(1-hydroxy-6-methylsulfonylpyridazin-4-ylidene)-3-propan-2-ylurea Traditional Name: (1E)-1-(1-hydroxy-6-mesyl-pyridazin-4-ylidene)-3-isopropyl-urea Formula: C9H14N4O4S MolecularWeight: 274.29686

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)N=C1C=C(N(N=C1)O)S(=O)(=O)C

Isomeric SMILES

CC(C)NC(=O)/N=C/1\C=C(N(N=C1)O)S(=O)(=O)C

InChI

InChI=1S/C9H14N4O4S/c1-6(2)11-9(14)12-7-4-8(18(3,16)17)13(15)10-5-7/h4-6,15H,1-3H3,(H,11,14)/b12-7+