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

Systemtic Name: 4-fluoranyl-N-[2-(furan-2-ylmethylcarbamoyl)phenyl]-3-methyl-1-benzothiophene-2-carboxamide Openeye Name: 4-fluoro-N-[2-(2-furylmethylcarbamoyl)phenyl]-3-methyl-benzothiophene-2-carboxamide CAS Name: 4-fluoro-N-[2-[(2-furanylmethylamino)-oxomethyl]phenyl]-3-methyl-1-benzothiophene-2-carboxamide IUPAC Name: 4-fluoro-N-[2-(furan-2-ylmethylcarbamoyl)phenyl]-3-methyl-1-benzothiophene-2-carboxamide Traditional Name: 4-fluoro-N-[2-(2-furfurylcarbamoyl)phenyl]-3-methyl-benzothiophene-2-carboxamide Formula: C22H17FN2O3S MolecularWeight: 408.445383

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=CC=CC(=C12)F)C(=O)NC3=CC=CC=C3C(=O)NCC4=CC=CO4

Isomeric SMILES

CC1=C(SC2=CC=CC(=C12)F)C(=O)NC3=CC=CC=C3C(=O)NCC4=CC=CO4

InChI

InChI=1S/C22H17FN2O3S/c1-13-19-16(23)8-4-10-18(19)29-20(13)22(27)25-17-9-3-2-7-15(17)21(26)24-12-14-6-5-11-28-14/h2-11H,12H2,1H3,(H,24,26)(H,25,27)