diethyl 2-(2-phenylethanethioylamino)propanedioate

Systemtic Name: diethyl 2-(2-phenylethanethioylamino)propanedioate Openeye Name: diethyl 2-[(2-phenylethanethioyl)amino]propanedioate CAS Name: 2-[(2-phenyl-1-sulfanylideneethyl)amino]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[(2-phenylethanethioyl)amino]propanedioate Traditional Name: 2-[(2-phenylthioacetyl)amino]malonic acid diethyl ester Formula: C15H19NO4S MolecularWeight: 309.38066

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(=O)OCC)NC(=S)CC1=CC=CC=C1

Isomeric SMILES

CCOC(=O)C(C(=O)OCC)NC(=S)CC1=CC=CC=C1

InChI

InChI=1S/C15H19NO4S/c1-3-19-14(17)13(15(18)20-4-2)16-12(21)10-11-8-6-5-7-9-11/h5-9,13H,3-4,10H2,1-2H3,(H,16,21)