N-(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)-4-fluoranyl-3-(methoxymethyl)-1-benzothiophene-2-carboxamide

Systemtic Name: N-(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)-4-fluoranyl-3-(methoxymethyl)-1-benzothiophene-2-carboxamide Openeye Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-4-fluoro-3-(methoxymethyl)benzothiophene-2-carboxamide CAS Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-4-fluoro-3-(methoxymethyl)-1-benzothiophene-2-carboxamide IUPAC Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-4-fluoro-3-(methoxymethyl)-1-benzothiophene-2-carboxamide Traditional Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-4-fluoro-3-(methoxymethyl)benzothiophene-2-carboxamide Formula: C19H15BrFNO4S MolecularWeight: 452.294103

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Descriptors Computed from Structure

Canonical SMILES:

COCC1=C(SC2=CC=CC(=C21)F)C(=O)NC3=CC4=C(C=C3Br)OCCO4

Isomeric SMILES

COCC1=C(SC2=CC=CC(=C21)F)C(=O)NC3=CC4=C(C=C3Br)OCCO4

InChI

InChI=1S/C19H15BrFNO4S/c1-24-9-10-17-12(21)3-2-4-16(17)27-18(10)19(23)22-13-8-15-14(7-11(13)20)25-5-6-26-15/h2-4,7-8H,5-6,9H2,1H3,(H,22,23)