N-(4,6-dimethoxypyrimidin-2-yl)-1-(phenylsulfonyl)cyclopentane-1-carboxamide

Systemtic Name: N-(4,6-dimethoxypyrimidin-2-yl)-1-(phenylsulfonyl)cyclopentane-1-carboxamide Openeye Name: 1-(benzenesulfonyl)-N-(4,6-dimethoxypyrimidin-2-yl)cyclopentanecarboxamide CAS Name: 1-(benzenesulfonyl)-N-(4,6-dimethoxy-2-pyrimidinyl)-1-cyclopentanecarboxamide IUPAC Name: 1-(benzenesulfonyl)-N-(4,6-dimethoxypyrimidin-2-yl)cyclopentane-1-carboxamide Traditional Name: 1-besyl-N-(4,6-dimethoxypyrimidin-2-yl)cyclopentanecarboxamide Formula: C18H21N3O5S MolecularWeight: 391.44144

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=NC(=N1)NC(=O)C2(CCCC2)S(=O)(=O)C3=CC=CC=C3)OC

Isomeric SMILES

COC1=CC(=NC(=N1)NC(=O)C2(CCCC2)S(=O)(=O)C3=CC=CC=C3)OC

InChI

InChI=1S/C18H21N3O5S/c1-25-14-12-15(26-2)20-17(19-14)21-16(22)18(10-6-7-11-18)27(23,24)13-8-4-3-5-9-13/h3-5,8-9,12H,6-7,10-11H2,1-2H3,(H,19,20,21,22)