heptyl N-[1,1-bis(oxidanylidene)-2,3-dihydrothiophen-3-yl]carbamodithioate

Systemtic Name: heptyl N-[1,1-bis(oxidanylidene)-2,3-dihydrothiophen-3-yl]carbamodithioate Openeye Name: heptyl N-(1,1-dioxo-2,3-dihydrothiophen-3-yl)carbamodithioate CAS Name: N-(1,1-dioxo-2,3-dihydrothiophen-3-yl)carbamodithioic acid heptyl ester IUPAC Name: heptyl N-(1,1-dioxo-2,3-dihydrothiophen-3-yl)carbamodithioate Traditional Name: N-(1,1-diketo-2,3-dihydrothiophen-3-yl)carbamodithioic acid heptyl ester Formula: C12H21NO2S3 MolecularWeight: 307.49564

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCSC(=S)NC1CS(=O)(=O)C=C1

Isomeric SMILES

CCCCCCCSC(=S)NC1CS(=O)(=O)C=C1

InChI

InChI=1S/C12H21NO2S3/c1-2-3-4-5-6-8-17-12(16)13-11-7-9-18(14,15)10-11/h7,9,11H,2-6,8,10H2,1H3,(H,13,16)