N-[[2-(dimethylamino)-5-(propanoylamino)phenyl]methyl]-3-fluoranyl-N-propan-2-yl-benzamide

Systemtic Name: N-[[2-(dimethylamino)-5-(propanoylamino)phenyl]methyl]-3-fluoranyl-N-propan-2-yl-benzamide Openeye Name: N-[[2-(dimethylamino)-5-(propanoylamino)phenyl]methyl]-3-fluoro-N-isopropyl-benzamide CAS Name: N-[[2-(dimethylamino)-5-(1-oxopropylamino)phenyl]methyl]-3-fluoro-N-propan-2-ylbenzamide IUPAC Name: N-[[2-(dimethylamino)-5-(propanoylamino)phenyl]methyl]-3-fluoro-N-propan-2-ylbenzamide Traditional Name: N-[2-(dimethylamino)-5-propionamido-benzyl]-3-fluoro-N-isopropyl-benzamide Formula: C22H28FN3O2 MolecularWeight: 385.475023

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC(=C(C=C1)N(C)C)CN(C(C)C)C(=O)C2=CC(=CC=C2)F

Isomeric SMILES

CCC(=O)NC1=CC(=C(C=C1)N(C)C)CN(C(C)C)C(=O)C2=CC(=CC=C2)F

InChI

InChI=1S/C22H28FN3O2/c1-6-21(27)24-19-10-11-20(25(4)5)17(13-19)14-26(15(2)3)22(28)16-8-7-9-18(23)12-16/h7-13,15H,6,14H2,1-5H3,(H,24,27)