4-fluoranyl-N-[[3-(2-methylpropanoylamino)phenyl]methyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 4-fluoranyl-N-[[3-(2-methylpropanoylamino)phenyl]methyl]-1-benzothiophene-2-carboxamide Openeye Name: 4-fluoro-N-[[3-(2-methylpropanoylamino)phenyl]methyl]benzothiophene-2-carboxamide CAS Name: 4-fluoro-N-[[3-[(2-methyl-1-oxopropyl)amino]phenyl]methyl]-1-benzothiophene-2-carboxamide IUPAC Name: 4-fluoro-N-[[3-(2-methylpropanoylamino)phenyl]methyl]-1-benzothiophene-2-carboxamide Traditional Name: 4-fluoro-N-[3-(isobutyrylamino)benzyl]benzothiophene-2-carboxamide Formula: C20H19FN2O2S MolecularWeight: 370.440463

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=CC=CC(=C1)CNC(=O)C2=CC3=C(C=CC=C3S2)F

Isomeric SMILES

CC(C)C(=O)NC1=CC=CC(=C1)CNC(=O)C2=CC3=C(C=CC=C3S2)F

InChI

InChI=1S/C20H19FN2O2S/c1-12(2)19(24)23-14-6-3-5-13(9-14)11-22-20(25)18-10-15-16(21)7-4-8-17(15)26-18/h3-10,12H,11H2,1-2H3,(H,22,25)(H,23,24)