S-[2-(2-azanyl-2-oxidanylidene-ethyl)sulfanylethyl] benzenecarbothioate

Systemtic Name: S-[2-(2-azanyl-2-oxidanylidene-ethyl)sulfanylethyl] benzenecarbothioate Openeye Name: S-[2-(2-amino-2-oxo-ethyl)sulfanylethyl] benzenecarbothioate CAS Name: benzenecarbothioic acid S-[2-[(2-amino-2-oxoethyl)thio]ethyl] ester IUPAC Name: S-[2-(2-amino-2-oxoethyl)sulfanylethyl] benzenecarbothioate Traditional Name: thiobenzoic acid S-[2-[(2-amino-2-keto-ethyl)thio]ethyl] ester Formula: C11H13NO2S2 MolecularWeight: 255.35642

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)SCCSCC(=O)N

Isomeric SMILES

C1=CC=C(C=C1)C(=O)SCCSCC(=O)N

InChI

InChI=1S/C11H13NO2S2/c12-10(13)8-15-6-7-16-11(14)9-4-2-1-3-5-9/h1-5H,6-8H2,(H2,12,13)