[1-(tert-butylamino)-1-oxidanylidene-propan-2-yl] 2-[(3,4-dichlorophenyl)methylsulfanyl]ethanoate

Systemtic Name: [1-(tert-butylamino)-1-oxidanylidene-propan-2-yl] 2-[(3,4-dichlorophenyl)methylsulfanyl]ethanoate Openeye Name: [2-(tert-butylamino)-1-methyl-2-oxo-ethyl] 2-[(3,4-dichlorophenyl)methylsulfanyl]acetate CAS Name: 2-[(3,4-dichlorophenyl)methylthio]acetic acid [1-(tert-butylamino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(tert-butylamino)-1-oxopropan-2-yl] 2-[(3,4-dichlorophenyl)methylsulfanyl]acetate Traditional Name: 2-[(3,4-dichlorobenzyl)thio]acetic acid [2-(tert-butylamino)-2-keto-1-methyl-ethyl] ester Formula: C16H21Cl2NO3S MolecularWeight: 378.31384

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(C)(C)C)OC(=O)CSCC1=CC(=C(C=C1)Cl)Cl

Isomeric SMILES

CC(C(=O)NC(C)(C)C)OC(=O)CSCC1=CC(=C(C=C1)Cl)Cl

InChI

InChI=1S/C16H21Cl2NO3S/c1-10(15(21)19-16(2,3)4)22-14(20)9-23-8-11-5-6-12(17)13(18)7-11/h5-7,10H,8-9H2,1-4H3,(H,19,21)