N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-4-bromanyl-N-[(4-dimethylaminophenyl)methyl]benzamide

Systemtic Name: N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-4-bromanyl-N-[(4-dimethylaminophenyl)methyl]benzamide Openeye Name: 4-bromo-N-[(4-dimethylaminophenyl)methyl]-N-[(3S)-1,1-dioxothiolan-3-yl]benzamide CAS Name: 4-bromo-N-[(4-dimethylaminophenyl)methyl]-N-[(3S)-1,1-dioxo-3-thiolanyl]benzamide IUPAC Name: 4-bromo-N-[(4-dimethylaminophenyl)methyl]-N-[(3S)-1,1-dioxothiolan-3-yl]benzamide Traditional Name: 4-bromo-N-[(3S)-1,1-diketothiolan-3-yl]-N-[4-(dimethylamino)benzyl]benzamide Formula: C20H23BrN2O3S MolecularWeight: 451.37722

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)CN(C2CCS(=O)(=O)C2)C(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CN(C)C1=CC=C(C=C1)CN([C@H]2CCS(=O)(=O)C2)C(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C20H23BrN2O3S/c1-22(2)18-9-3-15(4-10-18)13-23(19-11-12-27(25,26)14-19)20(24)16-5-7-17(21)8-6-16/h3-10,19H,11-14H2,1-2H3/t19-/m0/s1