N-[4-(2,4-dimethoxyphenyl)-1,3-thiazol-2-yl]-4-(4-fluorophenyl)sulfonyl-butanamide

Systemtic Name: N-[4-(2,4-dimethoxyphenyl)-1,3-thiazol-2-yl]-4-(4-fluorophenyl)sulfonyl-butanamide Openeye Name: N-[4-(2,4-dimethoxyphenyl)thiazol-2-yl]-4-(4-fluorophenyl)sulfonyl-butanamide CAS Name: N-[4-(2,4-dimethoxyphenyl)-2-thiazolyl]-4-(4-fluorophenyl)sulfonylbutanamide IUPAC Name: N-[4-(2,4-dimethoxyphenyl)-1,3-thiazol-2-yl]-4-(4-fluorophenyl)sulfonylbutanamide Traditional Name: N-[4-(2,4-dimethoxyphenyl)thiazol-2-yl]-4-(4-fluorophenyl)sulfonyl-butyramide Formula: C21H21FN2O5S2 MolecularWeight: 464.530243

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C2=CSC(=N2)NC(=O)CCCS(=O)(=O)C3=CC=C(C=C3)F)OC

Isomeric SMILES

COC1=CC(=C(C=C1)C2=CSC(=N2)NC(=O)CCCS(=O)(=O)C3=CC=C(C=C3)F)OC

InChI

InChI=1S/C21H21FN2O5S2/c1-28-15-7-10-17(19(12-15)29-2)18-13-30-21(23-18)24-20(25)4-3-11-31(26,27)16-8-5-14(22)6-9-16/h5-10,12-13H,3-4,11H2,1-2H3,(H,23,24,25)