2-[1-[2-[[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]amino]-2-oxidanylidene-ethyl]cyclopentyl]ethanoic acid

Systemtic Name: 2-[1-[2-[[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]amino]-2-oxidanylidene-ethyl]cyclopentyl]ethanoic acid Openeye Name: 2-[1-[2-[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]anilino]-2-oxo-ethyl]cyclopentyl]acetic acid CAS Name: 2-[1-[2-[4-[(4,6-dimethyl-2-pyrimidinyl)sulfamoyl]anilino]-2-oxoethyl]cyclopentyl]acetic acid IUPAC Name: 2-[1-[2-[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]anilino]-2-oxoethyl]cyclopentyl]acetic acid Traditional Name: 2-[1-[2-[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]anilino]-2-keto-ethyl]cyclopentyl]acetic acid Formula: C21H26N4O5S MolecularWeight: 446.51994

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)CC3(CCCC3)CC(=O)O)C

Isomeric SMILES

CC1=CC(=NC(=N1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)CC3(CCCC3)CC(=O)O)C

InChI

InChI=1S/C21H26N4O5S/c1-14-11-15(2)23-20(22-14)25-31(29,30)17-7-5-16(6-8-17)24-18(26)12-21(13-19(27)28)9-3-4-10-21/h5-8,11H,3-4,9-10,12-13H2,1-2H3,(H,24,26)(H,27,28)(H,22,23,25)