1-(4,6-dimethoxypyrimidin-2-yl)-3-(1-pyrrolidin-1-ylsulfonylethylsulfonyl)urea

Systemtic Name: 1-(4,6-dimethoxypyrimidin-2-yl)-3-(1-pyrrolidin-1-ylsulfonylethylsulfonyl)urea Openeye Name: 1-(4,6-dimethoxypyrimidin-2-yl)-3-(1-pyrrolidin-1-ylsulfonylethylsulfonyl)urea CAS Name: 1-(4,6-dimethoxy-2-pyrimidinyl)-3-[1-(1-pyrrolidinylsulfonyl)ethylsulfonyl]urea IUPAC Name: 1-(4,6-dimethoxypyrimidin-2-yl)-3-(1-pyrrolidin-1-ylsulfonylethylsulfonyl)urea Traditional Name: 1-(4,6-dimethoxypyrimidin-2-yl)-3-(1-pyrrolidinosulfonylethylsulfonyl)urea Formula: C13H21N5O7S2 MolecularWeight: 423.46514

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Descriptors Computed from Structure

Canonical SMILES:

CC(S(=O)(=O)NC(=O)NC1=NC(=CC(=N1)OC)OC)S(=O)(=O)N2CCCC2

Isomeric SMILES

CC(S(=O)(=O)NC(=O)NC1=NC(=CC(=N1)OC)OC)S(=O)(=O)N2CCCC2

InChI

InChI=1S/C13H21N5O7S2/c1-9(27(22,23)18-6-4-5-7-18)26(20,21)17-13(19)16-12-14-10(24-2)8-11(15-12)25-3/h8-9H,4-7H2,1-3H3,(H2,14,15,16,17,19)