[2-oxidanylidene-2-(prop-2-ynylamino)ethyl] 2-(1,3-benzothiazol-2-ylmethoxy)ethanoate

Systemtic Name: [2-oxidanylidene-2-(prop-2-ynylamino)ethyl] 2-(1,3-benzothiazol-2-ylmethoxy)ethanoate Openeye Name: [2-oxo-2-(prop-2-ynylamino)ethyl] 2-(1,3-benzothiazol-2-ylmethoxy)acetate CAS Name: 2-(1,3-benzothiazol-2-ylmethoxy)acetic acid [2-oxo-2-(prop-2-ynylamino)ethyl] ester IUPAC Name: [2-oxo-2-(prop-2-ynylamino)ethyl] 2-(1,3-benzothiazol-2-ylmethoxy)acetate Traditional Name: 2-(1,3-benzothiazol-2-ylmethoxy)acetic acid [2-keto-2-(propargylamino)ethyl] ester Formula: C15H14N2O4S MolecularWeight: 318.34766

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Descriptors Computed from Structure

Canonical SMILES:

C#CCNC(=O)COC(=O)COCC1=NC2=CC=CC=C2S1

Isomeric SMILES

C#CCNC(=O)COC(=O)COCC1=NC2=CC=CC=C2S1

InChI

InChI=1S/C15H14N2O4S/c1-2-7-16-13(18)8-21-15(19)10-20-9-14-17-11-5-3-4-6-12(11)22-14/h1,3-6H,7-10H2,(H,16,18)