N-[3-(ethylcarbamoyl)phenyl]-4-fluoranyl-3-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[3-(ethylcarbamoyl)phenyl]-4-fluoranyl-3-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-[3-(ethylcarbamoyl)phenyl]-4-fluoro-3-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-[3-(ethylcarbamoyl)phenyl]-4-fluoro-3-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-[3-(ethylcarbamoyl)phenyl]-4-fluoro-3-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-[3-(ethylcarbamoyl)phenyl]-4-fluoro-3-pyrrolidinosulfonyl-benzamide Formula: C20H22FN3O4S MolecularWeight: 419.469783

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C1=CC(=CC=C1)NC(=O)C2=CC(=C(C=C2)F)S(=O)(=O)N3CCCC3

Isomeric SMILES

CCNC(=O)C1=CC(=CC=C1)NC(=O)C2=CC(=C(C=C2)F)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C20H22FN3O4S/c1-2-22-19(25)14-6-5-7-16(12-14)23-20(26)15-8-9-17(21)18(13-15)29(27,28)24-10-3-4-11-24/h5-9,12-13H,2-4,10-11H2,1H3,(H,22,25)(H,23,26)