4-fluoranyl-3-(methoxymethyl)-N-[(3S)-1-(phenylmethyl)pyrrolidin-3-yl]-1-benzothiophene-2-carboxamide

Systemtic Name: 4-fluoranyl-3-(methoxymethyl)-N-[(3S)-1-(phenylmethyl)pyrrolidin-3-yl]-1-benzothiophene-2-carboxamide Openeye Name: N-[(3S)-1-benzylpyrrolidin-3-yl]-4-fluoro-3-(methoxymethyl)benzothiophene-2-carboxamide CAS Name: 4-fluoro-3-(methoxymethyl)-N-[(3S)-1-(phenylmethyl)-3-pyrrolidinyl]-1-benzothiophene-2-carboxamide IUPAC Name: N-[(3S)-1-benzylpyrrolidin-3-yl]-4-fluoro-3-(methoxymethyl)-1-benzothiophene-2-carboxamide Traditional Name: N-[(3S)-1-benzylpyrrolidin-3-yl]-4-fluoro-3-(methoxymethyl)benzothiophene-2-carboxamide Formula: C22H23FN2O2S MolecularWeight: 398.493623

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Descriptors Computed from Structure

Canonical SMILES:

COCC1=C(SC2=CC=CC(=C21)F)C(=O)NC3CCN(C3)CC4=CC=CC=C4

Isomeric SMILES

COCC1=C(SC2=CC=CC(=C21)F)C(=O)N[C@H]3CCN(C3)CC4=CC=CC=C4

InChI

InChI=1S/C22H23FN2O2S/c1-27-14-17-20-18(23)8-5-9-19(20)28-21(17)22(26)24-16-10-11-25(13-16)12-15-6-3-2-4-7-15/h2-9,16H,10-14H2,1H3,(H,24,26)/t16-/m0/s1