N-(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)-2-(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)ethanamide

Systemtic Name: N-(6-bromanyl-2,3-dihydro-1,4-benzodioxin-7-yl)-2-(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)ethanamide Openeye Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-2-(5-pyrrolidin-1-ylsulfonyl-2-thienyl)acetamide CAS Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-2-[5-(1-pyrrolidinylsulfonyl)-2-thiophenyl]acetamide IUPAC Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-2-(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)acetamide Traditional Name: N-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)-2-(5-pyrrolidinosulfonyl-2-thienyl)acetamide Formula: C18H19BrN2O5S2 MolecularWeight: 487.38786

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(S2)CC(=O)NC3=CC4=C(C=C3Br)OCCO4

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(S2)CC(=O)NC3=CC4=C(C=C3Br)OCCO4

InChI

InChI=1S/C18H19BrN2O5S2/c19-13-10-15-16(26-8-7-25-15)11-14(13)20-17(22)9-12-3-4-18(27-12)28(23,24)21-5-1-2-6-21/h3-4,10-11H,1-2,5-9H2,(H,20,22)