4-[[5-cyano-4-(oxolan-3-ylmethoxy)pyrimidin-2-yl]amino]-N-(3-methoxypropyl)benzenesulfonamide

Systemtic Name: 4-[[5-cyano-4-(oxolan-3-ylmethoxy)pyrimidin-2-yl]amino]-N-(3-methoxypropyl)benzenesulfonamide Openeye Name: 4-[[5-cyano-4-(tetrahydrofuran-3-ylmethoxy)pyrimidin-2-yl]amino]-N-(3-methoxypropyl)benzenesulfonamide CAS Name: 4-[[5-cyano-4-(3-oxolanylmethoxy)-2-pyrimidinyl]amino]-N-(3-methoxypropyl)benzenesulfonamide IUPAC Name: 4-[[5-cyano-4-(oxolan-3-ylmethoxy)pyrimidin-2-yl]amino]-N-(3-methoxypropyl)benzenesulfonamide Traditional Name: 4-[[5-cyano-4-(tetrahydrofuran-3-ylmethoxy)pyrimidin-2-yl]amino]-N-(3-methoxypropyl)benzenesulfonamide Formula: C20H25N5O5S MolecularWeight: 447.508

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Descriptors Computed from Structure

Canonical SMILES:

COCCCNS(=O)(=O)C1=CC=C(C=C1)NC2=NC=C(C(=N2)OCC3CCOC3)C#N

Isomeric SMILES

COCCCNS(=O)(=O)C1=CC=C(C=C1)NC2=NC=C(C(=N2)OCC3CCOC3)C#N

InChI

InChI=1S/C20H25N5O5S/c1-28-9-2-8-23-31(26,27)18-5-3-17(4-6-18)24-20-22-12-16(11-21)19(25-20)30-14-15-7-10-29-13-15/h3-6,12,15,23H,2,7-10,13-14H2,1H3,(H,22,24,25)