[2-(methylcarbamoylamino)-2-oxidanylidene-ethyl] 2-(1,3-benzothiazol-2-ylsulfanyl)ethanoate

Systemtic Name: [2-(methylcarbamoylamino)-2-oxidanylidene-ethyl] 2-(1,3-benzothiazol-2-ylsulfanyl)ethanoate Openeye Name: [2-(methylcarbamoylamino)-2-oxo-ethyl] 2-(1,3-benzothiazol-2-ylsulfanyl)acetate CAS Name: 2-(1,3-benzothiazol-2-ylthio)acetic acid [2-(methylcarbamoylamino)-2-oxoethyl] ester IUPAC Name: [2-(methylcarbamoylamino)-2-oxoethyl] 2-(1,3-benzothiazol-2-ylsulfanyl)acetate Traditional Name: 2-(1,3-benzothiazol-2-ylthio)acetic acid [2-keto-2-(methylcarbamoylamino)ethyl] ester Formula: C13H13N3O4S2 MolecularWeight: 339.39002

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)NC(=O)COC(=O)CSC1=NC2=CC=CC=C2S1

Isomeric SMILES

CNC(=O)NC(=O)COC(=O)CSC1=NC2=CC=CC=C2S1

InChI

InChI=1S/C13H13N3O4S2/c1-14-12(19)16-10(17)6-20-11(18)7-21-13-15-8-4-2-3-5-9(8)22-13/h2-5H,6-7H2,1H3,(H2,14,16,17,19)