O-(phenylmethyl) N-[3-methyl-1,1-bis(oxidanylidene)thiolan-3-yl]carbamothioate

Systemtic Name: O-(phenylmethyl) N-[3-methyl-1,1-bis(oxidanylidene)thiolan-3-yl]carbamothioate Openeye Name: O-benzyl N-(3-methyl-1,1-dioxo-thiolan-3-yl)carbamothioate CAS Name: N-(3-methyl-1,1-dioxo-3-thiolanyl)carbamothioic acid O-(phenylmethyl) ester IUPAC Name: O-benzyl N-(3-methyl-1,1-dioxothiolan-3-yl)carbamothioate Traditional Name: N-(1,1-diketo-3-methyl-thiolan-3-yl)thiocarbamic acid O-benzyl ester Formula: C13H17NO3S2 MolecularWeight: 299.40898

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCS(=O)(=O)C1)NC(=S)OCC2=CC=CC=C2

Isomeric SMILES

CC1(CCS(=O)(=O)C1)NC(=S)OCC2=CC=CC=C2

InChI

InChI=1S/C13H17NO3S2/c1-13(7-8-19(15,16)10-13)14-12(18)17-9-11-5-3-2-4-6-11/h2-6H,7-10H2,1H3,(H,14,18)