N-[4-(cyanomethyl)phenyl]-4-fluoranyl-3-morpholin-4-ylsulfonyl-benzamide

Systemtic Name: N-[4-(cyanomethyl)phenyl]-4-fluoranyl-3-morpholin-4-ylsulfonyl-benzamide Openeye Name: N-[4-(cyanomethyl)phenyl]-4-fluoro-3-morpholinosulfonyl-benzamide CAS Name: N-[4-(cyanomethyl)phenyl]-4-fluoro-3-(4-morpholinylsulfonyl)benzamide IUPAC Name: N-[4-(cyanomethyl)phenyl]-4-fluoro-3-morpholin-4-ylsulfonylbenzamide Traditional Name: N-[4-(cyanomethyl)phenyl]-4-fluoro-3-morpholinosulfonyl-benzamide Formula: C19H18FN3O4S MolecularWeight: 403.427323

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=C(C=CC(=C2)C(=O)NC3=CC=C(C=C3)CC#N)F

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=C(C=CC(=C2)C(=O)NC3=CC=C(C=C3)CC#N)F

InChI

InChI=1S/C19H18FN3O4S/c20-17-6-3-15(13-18(17)28(25,26)23-9-11-27-12-10-23)19(24)22-16-4-1-14(2-5-16)7-8-21/h1-6,13H,7,9-12H2,(H,22,24)