N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-N-[(3-bromophenyl)methyl]-2-ethoxy-benzamide

Systemtic Name: N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-N-[(3-bromophenyl)methyl]-2-ethoxy-benzamide Openeye Name: N-[(3-bromophenyl)methyl]-N-[(3S)-1,1-dioxothiolan-3-yl]-2-ethoxy-benzamide CAS Name: N-[(3-bromophenyl)methyl]-N-[(3S)-1,1-dioxo-3-thiolanyl]-2-ethoxybenzamide IUPAC Name: N-[(3-bromophenyl)methyl]-N-[(3S)-1,1-dioxothiolan-3-yl]-2-ethoxybenzamide Traditional Name: N-(3-bromobenzyl)-N-[(3S)-1,1-diketothiolan-3-yl]-2-ethoxy-benzamide Formula: C20H22BrNO4S MolecularWeight: 452.36198

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C(=O)N(CC2=CC(=CC=C2)Br)C3CCS(=O)(=O)C3

Isomeric SMILES

CCOC1=CC=CC=C1C(=O)N(CC2=CC(=CC=C2)Br)[C@H]3CCS(=O)(=O)C3

InChI

InChI=1S/C20H22BrNO4S/c1-2-26-19-9-4-3-8-18(19)20(23)22(17-10-11-27(24,25)14-17)13-15-6-5-7-16(21)12-15/h3-9,12,17H,2,10-11,13-14H2,1H3/t17-/m0/s1