5-bromanyl-N-[2-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperazin-1-yl]-2-oxidanylidene-ethyl]furan-2-carboxamide

Systemtic Name: 5-bromanyl-N-[2-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperazin-1-yl]-2-oxidanylidene-ethyl]furan-2-carboxamide Openeye Name: 5-bromo-N-[2-(4-indan-5-ylsulfonylpiperazin-1-yl)-2-oxo-ethyl]furan-2-carboxamide CAS Name: 5-bromo-N-[2-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)-1-piperazinyl]-2-oxoethyl]-2-furancarboxamide IUPAC Name: 5-bromo-N-[2-[4-(2,3-dihydro-1H-inden-5-ylsulfonyl)piperazin-1-yl]-2-oxoethyl]furan-2-carboxamide Traditional Name: 5-bromo-N-[2-(4-indan-5-ylsulfonylpiperazino)-2-keto-ethyl]-2-furamide Formula: C20H22BrN3O5S MolecularWeight: 496.37478

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)C=C(C=C2)S(=O)(=O)N3CCN(CC3)C(=O)CNC(=O)C4=CC=C(O4)Br

Isomeric SMILES

C1CC2=C(C1)C=C(C=C2)S(=O)(=O)N3CCN(CC3)C(=O)CNC(=O)C4=CC=C(O4)Br

InChI

InChI=1S/C20H22BrN3O5S/c21-18-7-6-17(29-18)20(26)22-13-19(25)23-8-10-24(11-9-23)30(27,28)16-5-4-14-2-1-3-15(14)12-16/h4-7,12H,1-3,8-11,13H2,(H,22,26)