4-hexadecoxy-4-sulfanylidene-butanethioic S-acid

Systemtic Name: 4-hexadecoxy-4-sulfanylidene-butanethioic S-acid Openeye Name: 4-hexadecoxy-4-thioxo-butanethioic S-acid CAS Name: 4-hexadecoxy-4-sulfanylidenebutanethioic S-acid IUPAC Name: 4-hexadecoxy-4-sulfanylidenebutanethioic S-acid Traditional Name: 4-cetyloxy-4-thioxo-thiobutyric acid Formula: C20H38O2S2 MolecularWeight: 374.64452

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC(=S)CCC(=O)S

Isomeric SMILES

CCCCCCCCCCCCCCCCOC(=S)CCC(=O)S

InChI

InChI=1S/C20H38O2S2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18-22-20(24)17-16-19(21)23/h2-18H2,1H3,(H,21,23)