N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-4-fluoranyl-3-methyl-1-benzothiophene-2-carboxamide

Systemtic Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-4-fluoranyl-3-methyl-1-benzothiophene-2-carboxamide Openeye Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-4-fluoro-3-methyl-benzothiophene-2-carboxamide CAS Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-4-fluoro-3-methyl-1-benzothiophene-2-carboxamide IUPAC Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-4-fluoro-3-methyl-1-benzothiophene-2-carboxamide Traditional Name: N-[[(3S)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-4-fluoro-3-methyl-benzothiophene-2-carboxamide Formula: C19H16FNO3S MolecularWeight: 357.398643

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=CC=CC(=C12)F)C(=O)NCC3COC4=CC=CC=C4O3

Isomeric SMILES

CC1=C(SC2=CC=CC(=C12)F)C(=O)NC[C@H]3COC4=CC=CC=C4O3

InChI

InChI=1S/C19H16FNO3S/c1-11-17-13(20)5-4-8-16(17)25-18(11)19(22)21-9-12-10-23-14-6-2-3-7-15(14)24-12/h2-8,12H,9-10H2,1H3,(H,21,22)/t12-/m0/s1