S-[2-(3-acetamidopropanoylamino)ethyl] but-2-ynethioate

Systemtic Name: S-[2-(3-acetamidopropanoylamino)ethyl] but-2-ynethioate Openeye Name: S-[2-(3-acetamidopropanoylamino)ethyl] but-2-ynethioate CAS Name: 2-butynethioic acid S-[2-[(3-acetamido-1-oxopropyl)amino]ethyl] ester IUPAC Name: S-[2-(3-acetamidopropanoylamino)ethyl] but-2-ynethioate Traditional Name: but-2-ynethioic acid S-[2-(3-acetamidopropanoylamino)ethyl] ester Formula: C11H16N2O3S MolecularWeight: 256.32134

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Descriptors Computed from Structure

Canonical SMILES:

CC#CC(=O)SCCNC(=O)CCNC(=O)C

Isomeric SMILES

CC#CC(=O)SCCNC(=O)CCNC(=O)C

InChI

InChI=1S/C11H16N2O3S/c1-3-4-11(16)17-8-7-13-10(15)5-6-12-9(2)14/h5-8H2,1-2H3,(H,12,14)(H,13,15)