S-[2-(3,3-dimethylbutanoylamino)ethyl] but-2-ynethioate

Systemtic Name: S-[2-(3,3-dimethylbutanoylamino)ethyl] but-2-ynethioate Openeye Name: S-[2-(3,3-dimethylbutanoylamino)ethyl] but-2-ynethioate CAS Name: 2-butynethioic acid S-[2-[(3,3-dimethyl-1-oxobutyl)amino]ethyl] ester IUPAC Name: S-[2-(3,3-dimethylbutanoylamino)ethyl] but-2-ynethioate Traditional Name: but-2-ynethioic acid S-[2-(3,3-dimethylbutanoylamino)ethyl] ester Formula: C12H19NO2S MolecularWeight: 241.34976

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H19NO2S/c1-5-6-11(15)16-8-7-13-10(14)9-12(2,3)4/h7-9H2,1-4H3,(H,13,14)