4-(1,3-benzodioxol-5-yloxymethyl)-N-(4-bromanyl-2-fluoranyl-phenyl)thiophene-2-carboxamide

Systemtic Name: 4-(1,3-benzodioxol-5-yloxymethyl)-N-(4-bromanyl-2-fluoranyl-phenyl)thiophene-2-carboxamide Openeye Name: 4-(1,3-benzodioxol-5-yloxymethyl)-N-(4-bromo-2-fluoro-phenyl)thiophene-2-carboxamide CAS Name: 4-(1,3-benzodioxol-5-yloxymethyl)-N-(4-bromo-2-fluorophenyl)-2-thiophenecarboxamide IUPAC Name: 4-(1,3-benzodioxol-5-yloxymethyl)-N-(4-bromo-2-fluorophenyl)thiophene-2-carboxamide Traditional Name: 4-(1,3-benzodioxol-5-yloxymethyl)-N-(4-bromo-2-fluoro-phenyl)thiophene-2-carboxamide Formula: C19H13BrFNO4S MolecularWeight: 450.278223

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)OCC3=CSC(=C3)C(=O)NC4=C(C=C(C=C4)Br)F

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)OCC3=CSC(=C3)C(=O)NC4=C(C=C(C=C4)Br)F

InChI

InChI=1S/C19H13BrFNO4S/c20-12-1-3-15(14(21)6-12)22-19(23)18-5-11(9-27-18)8-24-13-2-4-16-17(7-13)26-10-25-16/h1-7,9H,8,10H2,(H,22,23)