N-[2-(3,5-dimethylphenoxy)ethyl]-2-fluoranyl-5-morpholin-4-ylsulfonyl-benzamide

Systemtic Name: N-[2-(3,5-dimethylphenoxy)ethyl]-2-fluoranyl-5-morpholin-4-ylsulfonyl-benzamide Openeye Name: N-[2-(3,5-dimethylphenoxy)ethyl]-2-fluoro-5-morpholinosulfonyl-benzamide CAS Name: N-[2-(3,5-dimethylphenoxy)ethyl]-2-fluoro-5-(4-morpholinylsulfonyl)benzamide IUPAC Name: N-[2-(3,5-dimethylphenoxy)ethyl]-2-fluoro-5-morpholin-4-ylsulfonylbenzamide Traditional Name: N-[2-(3,5-dimethylphenoxy)ethyl]-2-fluoro-5-morpholinosulfonyl-benzamide Formula: C21H25FN2O5S MolecularWeight: 436.497003

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCCNC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)F)C

Isomeric SMILES

CC1=CC(=CC(=C1)OCCNC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)F)C

InChI

InChI=1S/C21H25FN2O5S/c1-15-11-16(2)13-17(12-15)29-8-5-23-21(25)19-14-18(3-4-20(19)22)30(26,27)24-6-9-28-10-7-24/h3-4,11-14H,5-10H2,1-2H3,(H,23,25)