S-[2-[2-(2-cyanoethoxy)ethylamino]ethyl] benzenecarbothioate

Systemtic Name: S-[2-[2-(2-cyanoethoxy)ethylamino]ethyl] benzenecarbothioate Openeye Name: S-[2-[2-(2-cyanoethoxy)ethylamino]ethyl] benzenecarbothioate CAS Name: benzenecarbothioic acid S-[2-[2-(2-cyanoethoxy)ethylamino]ethyl] ester IUPAC Name: S-[2-[2-(2-cyanoethoxy)ethylamino]ethyl] benzenecarbothioate Traditional Name: thiobenzoic acid S-[2-[2-(2-cyanoethoxy)ethylamino]ethyl] ester Formula: C14H18N2O2S MolecularWeight: 278.36992

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)SCCNCCOCCC#N

Isomeric SMILES

C1=CC=C(C=C1)C(=O)SCCNCCOCCC#N

InChI

InChI=1S/C14H18N2O2S/c15-7-4-10-18-11-8-16-9-12-19-14(17)13-5-2-1-3-6-13/h1-3,5-6,16H,4,8-12H2