[2-(tert-butylamino)-2-oxidanylidene-ethyl] 2-(2-oxidanylidenepropylsulfanyl)benzoate

Systemtic Name: [2-(tert-butylamino)-2-oxidanylidene-ethyl] 2-(2-oxidanylidenepropylsulfanyl)benzoate Openeye Name: [2-(tert-butylamino)-2-oxo-ethyl] 2-acetonylsulfanylbenzoate CAS Name: 2-(2-oxopropylthio)benzoic acid [2-(tert-butylamino)-2-oxoethyl] ester IUPAC Name: [2-(tert-butylamino)-2-oxoethyl] 2-(2-oxopropylsulfanyl)benzoate Traditional Name: 2-(acetonylthio)benzoic acid [2-(tert-butylamino)-2-keto-ethyl] ester Formula: C16H21NO4S MolecularWeight: 323.40724

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CSC1=CC=CC=C1C(=O)OCC(=O)NC(C)(C)C

Isomeric SMILES

CC(=O)CSC1=CC=CC=C1C(=O)OCC(=O)NC(C)(C)C

InChI

InChI=1S/C16H21NO4S/c1-11(18)10-22-13-8-6-5-7-12(13)15(20)21-9-14(19)17-16(2,3)4/h5-8H,9-10H2,1-4H3,(H,17,19)