[2-(tert-butylamino)-2-oxidanylidene-ethyl] 3-(4-chlorophenyl)sulfanylpropanoate

Systemtic Name: [2-(tert-butylamino)-2-oxidanylidene-ethyl] 3-(4-chlorophenyl)sulfanylpropanoate Openeye Name: [2-(tert-butylamino)-2-oxo-ethyl] 3-(4-chlorophenyl)sulfanylpropanoate CAS Name: 3-[(4-chlorophenyl)thio]propanoic acid [2-(tert-butylamino)-2-oxoethyl] ester IUPAC Name: [2-(tert-butylamino)-2-oxoethyl] 3-(4-chlorophenyl)sulfanylpropanoate Traditional Name: 3-[(4-chlorophenyl)thio]propionic acid [2-(tert-butylamino)-2-keto-ethyl] ester Formula: C15H20ClNO3S MolecularWeight: 329.8422

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)COC(=O)CCSC1=CC=C(C=C1)Cl

Isomeric SMILES

CC(C)(C)NC(=O)COC(=O)CCSC1=CC=C(C=C1)Cl

InChI

InChI=1S/C15H20ClNO3S/c1-15(2,3)17-13(18)10-20-14(19)8-9-21-12-6-4-11(16)5-7-12/h4-7H,8-10H2,1-3H3,(H,17,18)