5-(4-fluorophenyl)-N-[[3-(2-methylpropanoylamino)phenyl]methyl]thiophene-2-carboxamide

Systemtic Name: 5-(4-fluorophenyl)-N-[[3-(2-methylpropanoylamino)phenyl]methyl]thiophene-2-carboxamide Openeye Name: 5-(4-fluorophenyl)-N-[[3-(2-methylpropanoylamino)phenyl]methyl]thiophene-2-carboxamide CAS Name: 5-(4-fluorophenyl)-N-[[3-[(2-methyl-1-oxopropyl)amino]phenyl]methyl]-2-thiophenecarboxamide IUPAC Name: 5-(4-fluorophenyl)-N-[[3-(2-methylpropanoylamino)phenyl]methyl]thiophene-2-carboxamide Traditional Name: 5-(4-fluorophenyl)-N-[3-(isobutyrylamino)benzyl]thiophene-2-carboxamide Formula: C22H21FN2O2S MolecularWeight: 396.477743

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=CC=CC(=C1)CNC(=O)C2=CC=C(S2)C3=CC=C(C=C3)F

Isomeric SMILES

CC(C)C(=O)NC1=CC=CC(=C1)CNC(=O)C2=CC=C(S2)C3=CC=C(C=C3)F

InChI

InChI=1S/C22H21FN2O2S/c1-14(2)21(26)25-18-5-3-4-15(12-18)13-24-22(27)20-11-10-19(28-20)16-6-8-17(23)9-7-16/h3-12,14H,13H2,1-2H3,(H,24,27)(H,25,26)