N-[(1,5-dimethylpyrrol-2-yl)methyl]-2-fluoranyl-5-morpholin-4-ylsulfonyl-benzamide

Systemtic Name: N-[(1,5-dimethylpyrrol-2-yl)methyl]-2-fluoranyl-5-morpholin-4-ylsulfonyl-benzamide Openeye Name: N-[(1,5-dimethylpyrrol-2-yl)methyl]-2-fluoro-5-morpholinosulfonyl-benzamide CAS Name: N-[(1,5-dimethyl-2-pyrrolyl)methyl]-2-fluoro-5-(4-morpholinylsulfonyl)benzamide IUPAC Name: N-[(1,5-dimethylpyrrol-2-yl)methyl]-2-fluoro-5-morpholin-4-ylsulfonylbenzamide Traditional Name: N-[(1,5-dimethylpyrrol-2-yl)methyl]-2-fluoro-5-morpholinosulfonyl-benzamide Formula: C18H22FN3O4S MolecularWeight: 395.448383

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1C)CNC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)F

Isomeric SMILES

CC1=CC=C(N1C)CNC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCOCC3)F

InChI

InChI=1S/C18H22FN3O4S/c1-13-3-4-14(21(13)2)12-20-18(23)16-11-15(5-6-17(16)19)27(24,25)22-7-9-26-10-8-22/h3-6,11H,7-10,12H2,1-2H3,(H,20,23)