4-[[4-(2,3-dihydro-1-benzofuran-5-yl)pyrimidin-2-yl]amino]-N-(2-oxidanylideneethyl)benzenesulfonamide

Systemtic Name: 4-[[4-(2,3-dihydro-1-benzofuran-5-yl)pyrimidin-2-yl]amino]-N-(2-oxidanylideneethyl)benzenesulfonamide Openeye Name: 4-[[4-(2,3-dihydrobenzofuran-5-yl)pyrimidin-2-yl]amino]-N-(2-oxoethyl)benzenesulfonamide CAS Name: 4-[[4-(2,3-dihydrobenzofuran-5-yl)-2-pyrimidinyl]amino]-N-(2-oxoethyl)benzenesulfonamide IUPAC Name: 4-[[4-(2,3-dihydro-1-benzofuran-5-yl)pyrimidin-2-yl]amino]-N-(2-oxoethyl)benzenesulfonamide Traditional Name: 4-[(4-coumaran-5-ylpyrimidin-2-yl)amino]-N-(2-ketoethyl)benzenesulfonamide Formula: C20H18N4O4S MolecularWeight: 410.44632

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C1C=C(C=C2)C3=NC(=NC=C3)NC4=CC=C(C=C4)S(=O)(=O)NCC=O

Isomeric SMILES

C1COC2=C1C=C(C=C2)C3=NC(=NC=C3)NC4=CC=C(C=C4)S(=O)(=O)NCC=O

InChI

InChI=1S/C20H18N4O4S/c25-11-10-22-29(26,27)17-4-2-16(3-5-17)23-20-21-9-7-18(24-20)14-1-6-19-15(13-14)8-12-28-19/h1-7,9,11,13,22H,8,10,12H2,(H,21,23,24)