4-[[1,1-bis(oxidanylidene)thiolan-3-yl]-methyl-amino]benzenecarbothioamide

Systemtic Name: 4-[[1,1-bis(oxidanylidene)thiolan-3-yl]-methyl-amino]benzenecarbothioamide Openeye Name: 4-[(1,1-dioxothiolan-3-yl)-methyl-amino]benzenecarbothioamide CAS Name: 4-[(1,1-dioxo-3-thiolanyl)-methylamino]benzenecarbothioamide IUPAC Name: 4-[(1,1-dioxothiolan-3-yl)-methylamino]benzenecarbothioamide Traditional Name: 4-[(1,1-diketothiolan-3-yl)-methyl-amino]thiobenzamide Formula: C12H16N2O2S2 MolecularWeight: 284.39764

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCS(=O)(=O)C1)C2=CC=C(C=C2)C(=S)N

Isomeric SMILES

CN(C1CCS(=O)(=O)C1)C2=CC=C(C=C2)C(=S)N

InChI

InChI=1S/C12H16N2O2S2/c1-14(11-6-7-18(15,16)8-11)10-4-2-9(3-5-10)12(13)17/h2-5,11H,6-8H2,1H3,(H2,13,17)