3-[[[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-methyl-amino]methyl]-1,3-benzoxazole-2-thione

Systemtic Name: 3-[[[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-methyl-amino]methyl]-1,3-benzoxazole-2-thione Openeye Name: 3-[[[(3S)-1,1-dioxothiolan-3-yl]-methyl-amino]methyl]-1,3-benzoxazole-2-thione CAS Name: 3-[[[(3S)-1,1-dioxo-3-thiolanyl]-methylamino]methyl]-1,3-benzoxazole-2-thione IUPAC Name: 3-[[[(3S)-1,1-dioxothiolan-3-yl]-methylamino]methyl]-1,3-benzoxazole-2-thione Traditional Name: 3-[[[(3S)-1,1-diketothiolan-3-yl]-methyl-amino]methyl]-1,3-benzoxazole-2-thione Formula: C13H16N2O3S2 MolecularWeight: 312.40774

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Descriptors Computed from Structure

Canonical SMILES:

CN(CN1C2=CC=CC=C2OC1=S)C3CCS(=O)(=O)C3

Isomeric SMILES

CN(CN1C2=CC=CC=C2OC1=S)[C@H]3CCS(=O)(=O)C3

InChI

InChI=1S/C13H16N2O3S2/c1-14(10-6-7-20(16,17)8-10)9-15-11-4-2-3-5-12(11)18-13(15)19/h2-5,10H,6-9H2,1H3/t10-/m0/s1