[2-oxidanylidene-2-(prop-2-ynylamino)ethyl] 2-[(5-chloranylthiophen-2-yl)methylsulfanyl]ethanoate

Systemtic Name: [2-oxidanylidene-2-(prop-2-ynylamino)ethyl] 2-[(5-chloranylthiophen-2-yl)methylsulfanyl]ethanoate Openeye Name: [2-oxo-2-(prop-2-ynylamino)ethyl] 2-[(5-chloro-2-thienyl)methylsulfanyl]acetate CAS Name: 2-[(5-chloro-2-thiophenyl)methylthio]acetic acid [2-oxo-2-(prop-2-ynylamino)ethyl] ester IUPAC Name: [2-oxo-2-(prop-2-ynylamino)ethyl] 2-[(5-chlorothiophen-2-yl)methylsulfanyl]acetate Traditional Name: 2-[(5-chloro-2-thienyl)methylthio]acetic acid [2-keto-2-(propargylamino)ethyl] ester Formula: C12H12ClNO3S2 MolecularWeight: 317.81158

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Descriptors Computed from Structure

Canonical SMILES:

C#CCNC(=O)COC(=O)CSCC1=CC=C(S1)Cl

Isomeric SMILES

C#CCNC(=O)COC(=O)CSCC1=CC=C(S1)Cl

InChI

InChI=1S/C12H12ClNO3S2/c1-2-5-14-11(15)6-17-12(16)8-18-7-9-3-4-10(13)19-9/h1,3-4H,5-8H2,(H,14,15)