(2-methylphenyl) N-[[1,1-bis(oxidanylidene)thiolan-3-yl]methyl]carbamodithioate

Systemtic Name: (2-methylphenyl) N-[[1,1-bis(oxidanylidene)thiolan-3-yl]methyl]carbamodithioate Openeye Name: o-tolyl N-[(1,1-dioxothiolan-3-yl)methyl]carbamodithioate CAS Name: N-[(1,1-dioxo-3-thiolanyl)methyl]carbamodithioic acid (2-methylphenyl) ester IUPAC Name: (2-methylphenyl) N-[(1,1-dioxothiolan-3-yl)methyl]carbamodithioate Traditional Name: N-[(1,1-diketothiolan-3-yl)methyl]carbamodithioic acid o-tolyl ester Formula: C13H17NO2S3 MolecularWeight: 315.47458

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1SC(=S)NCC2CCS(=O)(=O)C2

Isomeric SMILES

CC1=CC=CC=C1SC(=S)NCC2CCS(=O)(=O)C2

InChI

InChI=1S/C13H17NO2S3/c1-10-4-2-3-5-12(10)18-13(17)14-8-11-6-7-19(15,16)9-11/h2-5,11H,6-9H2,1H3,(H,14,17)