[2-(tert-butylcarbamoylamino)-2-oxidanylidene-ethyl] 2-quinoxalin-2-ylsulfanylethanoate

Systemtic Name: [2-(tert-butylcarbamoylamino)-2-oxidanylidene-ethyl] 2-quinoxalin-2-ylsulfanylethanoate Openeye Name: [2-(tert-butylcarbamoylamino)-2-oxo-ethyl] 2-quinoxalin-2-ylsulfanylacetate CAS Name: 2-(2-quinoxalinylthio)acetic acid [2-[[(tert-butylamino)-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-(tert-butylcarbamoylamino)-2-oxoethyl] 2-quinoxalin-2-ylsulfanylacetate Traditional Name: 2-(quinoxalin-2-ylthio)acetic acid [2-(tert-butylcarbamoylamino)-2-keto-ethyl] ester Formula: C17H20N4O4S MolecularWeight: 376.4301

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)NC(=O)COC(=O)CSC1=NC2=CC=CC=C2N=C1

Isomeric SMILES

CC(C)(C)NC(=O)NC(=O)COC(=O)CSC1=NC2=CC=CC=C2N=C1

InChI

InChI=1S/C17H20N4O4S/c1-17(2,3)21-16(24)20-13(22)9-25-15(23)10-26-14-8-18-11-6-4-5-7-12(11)19-14/h4-8H,9-10H2,1-3H3,(H2,20,21,22,24)