[1-(tert-butylamino)-1-oxidanylidene-propan-2-yl] 2-(1,3-benzothiazol-2-ylsulfanyl)ethanoate

Systemtic Name: [1-(tert-butylamino)-1-oxidanylidene-propan-2-yl] 2-(1,3-benzothiazol-2-ylsulfanyl)ethanoate Openeye Name: [2-(tert-butylamino)-1-methyl-2-oxo-ethyl] 2-(1,3-benzothiazol-2-ylsulfanyl)acetate CAS Name: 2-(1,3-benzothiazol-2-ylthio)acetic acid [1-(tert-butylamino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(tert-butylamino)-1-oxopropan-2-yl] 2-(1,3-benzothiazol-2-ylsulfanyl)acetate Traditional Name: 2-(1,3-benzothiazol-2-ylthio)acetic acid [2-(tert-butylamino)-2-keto-1-methyl-ethyl] ester Formula: C16H20N2O3S2 MolecularWeight: 352.4716

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(C)(C)C)OC(=O)CSC1=NC2=CC=CC=C2S1

Isomeric SMILES

CC(C(=O)NC(C)(C)C)OC(=O)CSC1=NC2=CC=CC=C2S1

InChI

InChI=1S/C16H20N2O3S2/c1-10(14(20)18-16(2,3)4)21-13(19)9-22-15-17-11-7-5-6-8-12(11)23-15/h5-8,10H,9H2,1-4H3,(H,18,20)