1-(4,6-dimethoxypyrimidin-2-yl)-3-[2-(pyrrolidin-1-ylmethyl)phenyl]sulfonyl-urea

Systemtic Name: 1-(4,6-dimethoxypyrimidin-2-yl)-3-[2-(pyrrolidin-1-ylmethyl)phenyl]sulfonyl-urea Openeye Name: 1-(4,6-dimethoxypyrimidin-2-yl)-3-[2-(pyrrolidin-1-ylmethyl)phenyl]sulfonyl-urea CAS Name: 1-(4,6-dimethoxy-2-pyrimidinyl)-3-[2-(1-pyrrolidinylmethyl)phenyl]sulfonylurea IUPAC Name: 1-(4,6-dimethoxypyrimidin-2-yl)-3-[2-(pyrrolidin-1-ylmethyl)phenyl]sulfonylurea Traditional Name: 1-(4,6-dimethoxypyrimidin-2-yl)-3-[2-(pyrrolidinomethyl)phenyl]sulfonyl-urea Formula: C18H23N5O5S MolecularWeight: 421.47072

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=NC(=N1)NC(=O)NS(=O)(=O)C2=CC=CC=C2CN3CCCC3)OC

Isomeric SMILES

COC1=CC(=NC(=N1)NC(=O)NS(=O)(=O)C2=CC=CC=C2CN3CCCC3)OC

InChI

InChI=1S/C18H23N5O5S/c1-27-15-11-16(28-2)20-17(19-15)21-18(24)22-29(25,26)14-8-4-3-7-13(14)12-23-9-5-6-10-23/h3-4,7-8,11H,5-6,9-10,12H2,1-2H3,(H2,19,20,21,22,24)