S-[2-[(5-acetamido-1H-1,2,4-triazol-3-yl)-propan-2-yl-amino]ethyl] ethanethioate

Systemtic Name: S-[2-[(5-acetamido-1H-1,2,4-triazol-3-yl)-propan-2-yl-amino]ethyl] ethanethioate Openeye Name: S-[2-[(5-acetamido-1H-1,2,4-triazol-3-yl)-isopropyl-amino]ethyl] ethanethioate CAS Name: ethanethioic acid S-[2-[(5-acetamido-1H-1,2,4-triazol-3-yl)-propan-2-ylamino]ethyl] ester IUPAC Name: S-[2-[(5-acetamido-1H-1,2,4-triazol-3-yl)-propan-2-ylamino]ethyl] ethanethioate Traditional Name: ethanethioic acid S-[2-[(5-acetamido-1H-1,2,4-triazol-3-yl)-isopropyl-amino]ethyl] ester Formula: C11H19N5O2S MolecularWeight: 285.36586

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CCSC(=O)C)C1=NNC(=N1)NC(=O)C

Isomeric SMILES

CC(C)N(CCSC(=O)C)C1=NNC(=N1)NC(=O)C

InChI

InChI=1S/C11H19N5O2S/c1-7(2)16(5-6-19-9(4)18)11-13-10(14-15-11)12-8(3)17/h7H,5-6H2,1-4H3,(H2,12,13,14,15,17)