S-phenyl N-[3-methyl-1,1-bis(oxidanylidene)thiolan-3-yl]carbamothioate

Systemtic Name: S-phenyl N-[3-methyl-1,1-bis(oxidanylidene)thiolan-3-yl]carbamothioate Openeye Name: S-phenyl N-(3-methyl-1,1-dioxo-thiolan-3-yl)carbamothioate CAS Name: N-(3-methyl-1,1-dioxo-3-thiolanyl)carbamothioic acid S-phenyl ester IUPAC Name: S-phenyl N-(3-methyl-1,1-dioxothiolan-3-yl)carbamothioate Traditional Name: N-(1,1-diketo-3-methyl-thiolan-3-yl)thiocarbamic acid S-phenyl ester Formula: C12H15NO3S2 MolecularWeight: 285.3824

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CCS(=O)(=O)C1)NC(=O)SC2=CC=CC=C2

Isomeric SMILES

CC1(CCS(=O)(=O)C1)NC(=O)SC2=CC=CC=C2

InChI

InChI=1S/C12H15NO3S2/c1-12(7-8-18(15,16)9-12)13-11(14)17-10-5-3-2-4-6-10/h2-6H,7-9H2,1H3,(H,13,14)