N-[1-(2-azanyl-2-oxidanylidene-ethyl)piperidin-4-yl]-4-fluoranyl-3-(phenoxymethyl)-1-benzothiophene-2-carboxamide

Systemtic Name: N-[1-(2-azanyl-2-oxidanylidene-ethyl)piperidin-4-yl]-4-fluoranyl-3-(phenoxymethyl)-1-benzothiophene-2-carboxamide Openeye Name: N-[1-(2-amino-2-oxo-ethyl)-4-piperidyl]-4-fluoro-3-(phenoxymethyl)benzothiophene-2-carboxamide CAS Name: N-[1-(2-amino-2-oxoethyl)-4-piperidinyl]-4-fluoro-3-(phenoxymethyl)-1-benzothiophene-2-carboxamide IUPAC Name: N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-4-fluoro-3-(phenoxymethyl)-1-benzothiophene-2-carboxamide Traditional Name: N-[1-(2-amino-2-keto-ethyl)-4-piperidyl]-4-fluoro-3-(phenoxymethyl)benzothiophene-2-carboxamide Formula: C23H24FN3O3S MolecularWeight: 441.518363

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC(=O)C2=C(C3=C(C=CC=C3S2)F)COC4=CC=CC=C4)CC(=O)N

Isomeric SMILES

C1CN(CCC1NC(=O)C2=C(C3=C(C=CC=C3S2)F)COC4=CC=CC=C4)CC(=O)N

InChI

InChI=1S/C23H24FN3O3S/c24-18-7-4-8-19-21(18)17(14-30-16-5-2-1-3-6-16)22(31-19)23(29)26-15-9-11-27(12-10-15)13-20(25)28/h1-8,15H,9-14H2,(H2,25,28)(H,26,29)