4-(1H-benzimidazol-2-ylsulfanylmethyl)-N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-N-methyl-benzamide

Systemtic Name: 4-(1H-benzimidazol-2-ylsulfanylmethyl)-N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-N-methyl-benzamide Openeye Name: 4-(1H-benzimidazol-2-ylsulfanylmethyl)-N-[(3S)-1,1-dioxothiolan-3-yl]-N-methyl-benzamide CAS Name: 4-[(1H-benzimidazol-2-ylthio)methyl]-N-[(3S)-1,1-dioxo-3-thiolanyl]-N-methylbenzamide IUPAC Name: 4-(1H-benzimidazol-2-ylsulfanylmethyl)-N-[(3S)-1,1-dioxothiolan-3-yl]-N-methylbenzamide Traditional Name: 4-[(1H-benzimidazol-2-ylthio)methyl]-N-[(3S)-1,1-diketothiolan-3-yl]-N-methyl-benzamide Formula: C20H21N3O3S2 MolecularWeight: 415.52904

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCS(=O)(=O)C1)C(=O)C2=CC=C(C=C2)CSC3=NC4=CC=CC=C4N3

Isomeric SMILES

CN([C@H]1CCS(=O)(=O)C1)C(=O)C2=CC=C(C=C2)CSC3=NC4=CC=CC=C4N3

InChI

InChI=1S/C20H21N3O3S2/c1-23(16-10-11-28(25,26)13-16)19(24)15-8-6-14(7-9-15)12-27-20-21-17-4-2-3-5-18(17)22-20/h2-9,16H,10-13H2,1H3,(H,21,22)/t16-/m0/s1