5-bromanyl-N-[4-[(2S,6S)-2,6-dimethylpiperidin-1-yl]sulfonylphenyl]furan-2-carboxamide

Systemtic Name: 5-bromanyl-N-[4-[(2S,6S)-2,6-dimethylpiperidin-1-yl]sulfonylphenyl]furan-2-carboxamide Openeye Name: 5-bromo-N-[4-[[(2S,6S)-2,6-dimethyl-1-piperidyl]sulfonyl]phenyl]furan-2-carboxamide CAS Name: 5-bromo-N-[4-[[(2S,6S)-2,6-dimethyl-1-piperidinyl]sulfonyl]phenyl]-2-furancarboxamide IUPAC Name: 5-bromo-N-[4-[(2S,6S)-2,6-dimethylpiperidin-1-yl]sulfonylphenyl]furan-2-carboxamide Traditional Name: 5-bromo-N-[4-[(2S,6S)-2,6-dimethylpiperidino]sulfonylphenyl]-2-furamide Formula: C18H21BrN2O4S MolecularWeight: 441.33934

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(N1S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC=C(O3)Br)C

Isomeric SMILES

C[C@H]1CCC[C@@H](N1S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC=C(O3)Br)C

InChI

InChI=1S/C18H21BrN2O4S/c1-12-4-3-5-13(2)21(12)26(23,24)15-8-6-14(7-9-15)20-18(22)16-10-11-17(19)25-16/h6-13H,3-5H2,1-2H3,(H,20,22)/t12-,13-/m0/s1