ethyl 2-[4-(diethylamino)phenyl]carbonylsulfanylethanoate

Systemtic Name: ethyl 2-[4-(diethylamino)phenyl]carbonylsulfanylethanoate Openeye Name: ethyl 2-[4-(diethylamino)benzoyl]sulfanylacetate CAS Name: 2-[[[4-(diethylamino)phenyl]-oxomethyl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-(diethylamino)benzoyl]sulfanylacetate Traditional Name: 2-[[4-(diethylamino)benzoyl]thio]acetic acid ethyl ester Formula: C15H21NO3S MolecularWeight: 295.39714

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC=C(C=C1)C(=O)SCC(=O)OCC

Isomeric SMILES

CCN(CC)C1=CC=C(C=C1)C(=O)SCC(=O)OCC

InChI

InChI=1S/C15H21NO3S/c1-4-16(5-2)13-9-7-12(8-10-13)15(18)20-11-14(17)19-6-3/h7-10H,4-6,11H2,1-3H3