N-[4-[[4-(1-oxidanylidene-3,4-dihydroisochromen-3-yl)pyrimidin-2-yl]sulfamoyl]phenyl]ethanamide

Systemtic Name: N-[4-[[4-(1-oxidanylidene-3,4-dihydroisochromen-3-yl)pyrimidin-2-yl]sulfamoyl]phenyl]ethanamide Openeye Name: N-[4-[[4-(1-oxoisochroman-3-yl)pyrimidin-2-yl]sulfamoyl]phenyl]acetamide CAS Name: N-[4-[[4-(1-oxo-3,4-dihydro-1H-2-benzopyran-3-yl)-2-pyrimidinyl]sulfamoyl]phenyl]acetamide IUPAC Name: N-[4-[[4-(1-oxo-3,4-dihydroisochromen-3-yl)pyrimidin-2-yl]sulfamoyl]phenyl]acetamide Traditional Name: N-[4-[[4-(1-ketoisochroman-3-yl)pyrimidin-2-yl]sulfamoyl]phenyl]acetamide Formula: C21H18N4O5S MolecularWeight: 438.45642

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)NC2=NC=CC(=N2)C3CC4=CC=CC=C4C(=O)O3

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)NC2=NC=CC(=N2)C3CC4=CC=CC=C4C(=O)O3

InChI

InChI=1S/C21H18N4O5S/c1-13(26)23-15-6-8-16(9-7-15)31(28,29)25-21-22-11-10-18(24-21)19-12-14-4-2-3-5-17(14)20(27)30-19/h2-11,19H,12H2,1H3,(H,23,26)(H,22,24,25)