5-bromanyl-N-(2-piperidin-1-ylsulfonylethyl)-N-(pyridin-4-ylmethyl)furan-2-carboxamide; ethanedioic acid

Systemtic Name: 5-bromanyl-N-(2-piperidin-1-ylsulfonylethyl)-N-(pyridin-4-ylmethyl)furan-2-carboxamide; ethanedioic acid Openeye Name: 5-bromo-N-[2-(1-piperidylsulfonyl)ethyl]-N-(4-pyridylmethyl)furan-2-carboxamide; oxalic acid CAS Name: 5-bromo-N-[2-(1-piperidinylsulfonyl)ethyl]-N-(pyridin-4-ylmethyl)-2-furancarboxamide; oxalic acid IUPAC Name: 5-bromo-N-(2-piperidin-1-ylsulfonylethyl)-N-(pyridin-4-ylmethyl)furan-2-carboxamide; oxalic acid Traditional Name: 5-bromo-N-(2-piperidinosulfonylethyl)-N-(4-pyridylmethyl)-2-furamide; oxalic acid Formula: C20H24BrN3O8S MolecularWeight: 546.38886

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)CCN(CC2=CC=NC=C2)C(=O)C3=CC=C(O3)Br.C(=O)(C(=O)O)O

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)CCN(CC2=CC=NC=C2)C(=O)C3=CC=C(O3)Br.C(=O)(C(=O)O)O

InChI

InChI=1S/C18H22BrN3O4S.C2H2O4/c19-17-5-4-16(26-17)18(23)21(14-15-6-8-20-9-7-15)12-13-27(24,25)22-10-2-1-3-11-22;3-1(4)2(5)6/h4-9H,1-3,10-14H2;(H,3,4)(H,5,6)