3-[2-[[1,1-bis(oxidanylidene)thiolan-3-yl]-methyl-amino]ethoxy]benzenecarbothioamide

Systemtic Name: 3-[2-[[1,1-bis(oxidanylidene)thiolan-3-yl]-methyl-amino]ethoxy]benzenecarbothioamide Openeye Name: 3-[2-[(1,1-dioxothiolan-3-yl)-methyl-amino]ethoxy]benzenecarbothioamide CAS Name: 3-[2-[(1,1-dioxo-3-thiolanyl)-methylamino]ethoxy]benzenecarbothioamide IUPAC Name: 3-[2-[(1,1-dioxothiolan-3-yl)-methylamino]ethoxy]benzenecarbothioamide Traditional Name: 3-[2-[(1,1-diketothiolan-3-yl)-methyl-amino]ethoxy]thiobenzamide Formula: C14H20N2O3S2 MolecularWeight: 328.4502

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCOC1=CC=CC(=C1)C(=S)N)C2CCS(=O)(=O)C2

Isomeric SMILES

CN(CCOC1=CC=CC(=C1)C(=S)N)C2CCS(=O)(=O)C2

InChI

InChI=1S/C14H20N2O3S2/c1-16(12-5-8-21(17,18)10-12)6-7-19-13-4-2-3-11(9-13)14(15)20/h2-4,9,12H,5-8,10H2,1H3,(H2,15,20)