S-[2-[phenethyl(pyridin-3-ylmethylcarbamoyl)amino]ethyl] ethanethioate

Systemtic Name: S-[2-[phenethyl(pyridin-3-ylmethylcarbamoyl)amino]ethyl] ethanethioate Openeye Name: S-[2-[phenethyl(3-pyridylmethylcarbamoyl)amino]ethyl] ethanethioate CAS Name: ethanethioic acid S-[2-[[oxo-(3-pyridinylmethylamino)methyl]-phenethylamino]ethyl] ester IUPAC Name: S-[2-[phenethyl(pyridin-3-ylmethylcarbamoyl)amino]ethyl] ethanethioate Traditional Name: ethanethioic acid S-[2-[phenethyl(3-pyridylmethylcarbamoyl)amino]ethyl] ester Formula: C19H23N3O2S MolecularWeight: 357.46982

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCCN(CCC1=CC=CC=C1)C(=O)NCC2=CN=CC=C2

Isomeric SMILES

CC(=O)SCCN(CCC1=CC=CC=C1)C(=O)NCC2=CN=CC=C2

InChI

InChI=1S/C19H23N3O2S/c1-16(23)25-13-12-22(11-9-17-6-3-2-4-7-17)19(24)21-15-18-8-5-10-20-14-18/h2-8,10,14H,9,11-13,15H2,1H3,(H,21,24)