1-(4,6-dimethylpyrimidin-2-yl)-3-[2-(3-oxidanylidenecyclohexen-1-yl)thiophen-3-yl]sulfonyl-urea

Systemtic Name: 1-(4,6-dimethylpyrimidin-2-yl)-3-[2-(3-oxidanylidenecyclohexen-1-yl)thiophen-3-yl]sulfonyl-urea Openeye Name: 1-(4,6-dimethylpyrimidin-2-yl)-3-[[2-(3-oxocyclohexen-1-yl)-3-thienyl]sulfonyl]urea CAS Name: 1-(4,6-dimethyl-2-pyrimidinyl)-3-[[2-(3-oxo-1-cyclohexenyl)-3-thiophenyl]sulfonyl]urea IUPAC Name: 1-(4,6-dimethylpyrimidin-2-yl)-3-[2-(3-oxocyclohexen-1-yl)thiophen-3-yl]sulfonylurea Traditional Name: 1-(4,6-dimethylpyrimidin-2-yl)-3-[[2-(3-ketocyclohexen-1-yl)-3-thienyl]sulfonyl]urea Formula: C17H18N4O4S2 MolecularWeight: 406.47922

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NC(=O)NS(=O)(=O)C2=C(SC=C2)C3=CC(=O)CCC3)C

Isomeric SMILES

CC1=CC(=NC(=N1)NC(=O)NS(=O)(=O)C2=C(SC=C2)C3=CC(=O)CCC3)C

InChI

InChI=1S/C17H18N4O4S2/c1-10-8-11(2)19-16(18-10)20-17(23)21-27(24,25)14-6-7-26-15(14)12-4-3-5-13(22)9-12/h6-9H,3-5H2,1-2H3,(H2,18,19,20,21,23)