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

Systemtic Name: N-[4-(2,4-dimethylphenyl)-1,3-thiazol-2-yl]-4-(4-fluorophenyl)sulfonyl-butanamide Openeye Name: N-[4-(2,4-dimethylphenyl)thiazol-2-yl]-4-(4-fluorophenyl)sulfonyl-butanamide CAS Name: N-[4-(2,4-dimethylphenyl)-2-thiazolyl]-4-(4-fluorophenyl)sulfonylbutanamide IUPAC Name: N-[4-(2,4-dimethylphenyl)-1,3-thiazol-2-yl]-4-(4-fluorophenyl)sulfonylbutanamide Traditional Name: N-[4-(2,4-dimethylphenyl)thiazol-2-yl]-4-(4-fluorophenyl)sulfonyl-butyramide Formula: C21H21FN2O3S2 MolecularWeight: 432.531443

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C2=CSC(=N2)NC(=O)CCCS(=O)(=O)C3=CC=C(C=C3)F)C

Isomeric SMILES

CC1=CC(=C(C=C1)C2=CSC(=N2)NC(=O)CCCS(=O)(=O)C3=CC=C(C=C3)F)C

InChI

InChI=1S/C21H21FN2O3S2/c1-14-5-10-18(15(2)12-14)19-13-28-21(23-19)24-20(25)4-3-11-29(26,27)17-8-6-16(22)7-9-17/h5-10,12-13H,3-4,11H2,1-2H3,(H,23,24,25)