N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-N-[(5-bromanylfuran-2-yl)methyl]-3-butoxy-benzamide

Systemtic Name: N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-N-[(5-bromanylfuran-2-yl)methyl]-3-butoxy-benzamide Openeye Name: N-[(5-bromo-2-furyl)methyl]-3-butoxy-N-[(3S)-1,1-dioxothiolan-3-yl]benzamide CAS Name: N-[(5-bromo-2-furanyl)methyl]-3-butoxy-N-[(3S)-1,1-dioxo-3-thiolanyl]benzamide IUPAC Name: N-[(5-bromofuran-2-yl)methyl]-3-butoxy-N-[(3S)-1,1-dioxothiolan-3-yl]benzamide Traditional Name: N-[(5-bromo-2-furyl)methyl]-3-butoxy-N-[(3S)-1,1-diketothiolan-3-yl]benzamide Formula: C20H24BrNO5S MolecularWeight: 470.37726

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC(=C1)C(=O)N(CC2=CC=C(O2)Br)C3CCS(=O)(=O)C3

Isomeric SMILES

CCCCOC1=CC=CC(=C1)C(=O)N(CC2=CC=C(O2)Br)[C@H]3CCS(=O)(=O)C3

InChI

InChI=1S/C20H24BrNO5S/c1-2-3-10-26-17-6-4-5-15(12-17)20(23)22(13-18-7-8-19(21)27-18)16-9-11-28(24,25)14-16/h4-8,12,16H,2-3,9-11,13-14H2,1H3/t16-/m0/s1