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

Systemtic Name: N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-N-[(3-bromophenyl)methyl]-4-methyl-benzamide Openeye Name: N-[(3-bromophenyl)methyl]-N-[(3S)-1,1-dioxothiolan-3-yl]-4-methyl-benzamide CAS Name: N-[(3-bromophenyl)methyl]-N-[(3S)-1,1-dioxo-3-thiolanyl]-4-methylbenzamide IUPAC Name: N-[(3-bromophenyl)methyl]-N-[(3S)-1,1-dioxothiolan-3-yl]-4-methylbenzamide Traditional Name: N-(3-bromobenzyl)-N-[(3S)-1,1-diketothiolan-3-yl]-4-methyl-benzamide Formula: C19H20BrNO3S MolecularWeight: 422.336

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N(CC2=CC(=CC=C2)Br)C3CCS(=O)(=O)C3

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N(CC2=CC(=CC=C2)Br)[C@H]3CCS(=O)(=O)C3

InChI

InChI=1S/C19H20BrNO3S/c1-14-5-7-16(8-6-14)19(22)21(18-9-10-25(23,24)13-18)12-15-3-2-4-17(20)11-15/h2-8,11,18H,9-10,12-13H2,1H3/t18-/m0/s1