N-[(1S)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-propyl]-4-fluoranyl-3-methyl-1-benzothiophene-2-carboxamide

Systemtic Name: N-[(1S)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-propyl]-4-fluoranyl-3-methyl-1-benzothiophene-2-carboxamide Openeye Name: N-[(1S)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-propyl]-4-fluoro-3-methyl-benzothiophene-2-carboxamide CAS Name: N-[(1S)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methylpropyl]-4-fluoro-3-methyl-1-benzothiophene-2-carboxamide IUPAC Name: N-[(1S)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methylpropyl]-4-fluoro-3-methyl-1-benzothiophene-2-carboxamide Traditional Name: N-[(1S)-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-propyl]-4-fluoro-3-methyl-benzothiophene-2-carboxamide Formula: C23H24FNO3S MolecularWeight: 413.504963

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=CC=CC(=C12)F)C(=O)NC(C3=CC4=C(C=C3)OCCCO4)C(C)C

Isomeric SMILES

CC1=C(SC2=CC=CC(=C12)F)C(=O)N[C@H](C3=CC4=C(C=C3)OCCCO4)C(C)C

InChI

InChI=1S/C23H24FNO3S/c1-13(2)21(15-8-9-17-18(12-15)28-11-5-10-27-17)25-23(26)22-14(3)20-16(24)6-4-7-19(20)29-22/h4,6-9,12-13,21H,5,10-11H2,1-3H3,(H,25,26)/t21-/m0/s1