N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]azepane-1-carbothioamide

Systemtic Name: N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]azepane-1-carbothioamide Openeye Name: N-[(3S)-1,1-dioxothiolan-3-yl]azepane-1-carbothioamide CAS Name: N-[(3S)-1,1-dioxo-3-thiolanyl]-1-azepanecarbothioamide IUPAC Name: N-[(3S)-1,1-dioxothiolan-3-yl]azepane-1-carbothioamide Traditional Name: N-[(3S)-1,1-diketothiolan-3-yl]azepane-1-carbothioamide Formula: C11H20N2O2S2 MolecularWeight: 276.4187

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=S)NC2CCS(=O)(=O)C2

Isomeric SMILES

C1CCCN(CC1)C(=S)N[C@H]2CCS(=O)(=O)C2

InChI

InChI=1S/C11H20N2O2S2/c14-17(15)8-5-10(9-17)12-11(16)13-6-3-1-2-4-7-13/h10H,1-9H2,(H,12,16)/t10-/m0/s1