N-[4-(2,4-dimethylphenyl)-1,3-thiazol-2-yl]-2-fluoranyl-5-morpholin-4-ylsulfonyl-benzamide

Systemtic Name: N-[4-(2,4-dimethylphenyl)-1,3-thiazol-2-yl]-2-fluoranyl-5-morpholin-4-ylsulfonyl-benzamide Openeye Name: N-[4-(2,4-dimethylphenyl)thiazol-2-yl]-2-fluoro-5-morpholinosulfonyl-benzamide CAS Name: N-[4-(2,4-dimethylphenyl)-2-thiazolyl]-2-fluoro-5-(4-morpholinylsulfonyl)benzamide IUPAC Name: N-[4-(2,4-dimethylphenyl)-1,3-thiazol-2-yl]-2-fluoro-5-morpholin-4-ylsulfonylbenzamide Traditional Name: N-[4-(2,4-dimethylphenyl)thiazol-2-yl]-2-fluoro-5-morpholinosulfonyl-benzamide Formula: C22H22FN3O4S2 MolecularWeight: 475.556183

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C2=CSC(=N2)NC(=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCOCC4)F)C

Isomeric SMILES

CC1=CC(=C(C=C1)C2=CSC(=N2)NC(=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCOCC4)F)C

InChI

InChI=1S/C22H22FN3O4S2/c1-14-3-5-17(15(2)11-14)20-13-31-22(24-20)25-21(27)18-12-16(4-6-19(18)23)32(28,29)26-7-9-30-10-8-26/h3-6,11-13H,7-10H2,1-2H3,(H,24,25,27)