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

Systemtic Name: N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-4-bromanyl-N-[(4-ethylphenyl)methyl]benzamide Openeye Name: 4-bromo-N-[(3S)-1,1-dioxothiolan-3-yl]-N-[(4-ethylphenyl)methyl]benzamide CAS Name: 4-bromo-N-[(3S)-1,1-dioxo-3-thiolanyl]-N-[(4-ethylphenyl)methyl]benzamide IUPAC Name: 4-bromo-N-[(3S)-1,1-dioxothiolan-3-yl]-N-[(4-ethylphenyl)methyl]benzamide Traditional Name: 4-bromo-N-[(3S)-1,1-diketothiolan-3-yl]-N-(4-ethylbenzyl)benzamide Formula: C20H22BrNO3S MolecularWeight: 436.36258

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CN(C2CCS(=O)(=O)C2)C(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CCC1=CC=C(C=C1)CN([C@H]2CCS(=O)(=O)C2)C(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C20H22BrNO3S/c1-2-15-3-5-16(6-4-15)13-22(19-11-12-26(24,25)14-19)20(23)17-7-9-18(21)10-8-17/h3-10,19H,2,11-14H2,1H3/t19-/m0/s1