N-(2-tert-butylphenyl)-2-fluoranyl-5-morpholin-4-ylsulfonyl-benzamide

Systemtic Name: N-(2-tert-butylphenyl)-2-fluoranyl-5-morpholin-4-ylsulfonyl-benzamide Openeye Name: N-(2-tert-butylphenyl)-2-fluoro-5-morpholinosulfonyl-benzamide CAS Name: N-(2-tert-butylphenyl)-2-fluoro-5-(4-morpholinylsulfonyl)benzamide IUPAC Name: N-(2-tert-butylphenyl)-2-fluoro-5-morpholin-4-ylsulfonylbenzamide Traditional Name: N-(2-tert-butylphenyl)-2-fluoro-5-morpholinosulfonyl-benzamide Formula: C21H25FN2O4S MolecularWeight: 420.497603

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=CC=C1NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)F

Isomeric SMILES

CC(C)(C)C1=CC=CC=C1NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)F

InChI

InChI=1S/C21H25FN2O4S/c1-21(2,3)17-6-4-5-7-19(17)23-20(25)16-14-15(8-9-18(16)22)29(26,27)24-10-12-28-13-11-24/h4-9,14H,10-13H2,1-3H3,(H,23,25)