ethyl 4-(prop-2-enylcarbamothioylamino)benzoate

Systemtic Name: ethyl 4-(prop-2-enylcarbamothioylamino)benzoate Openeye Name: ethyl 4-(allylcarbamothioylamino)benzoate CAS Name: 4-[[(prop-2-enylamino)-sulfanylidenemethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-(prop-2-enylcarbamothioylamino)benzoate Traditional Name: 4-(allylthiocarbamoylamino)benzoic acid ethyl ester Formula: C13H16N2O2S MolecularWeight: 264.34334

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=S)NCC=C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=S)NCC=C

InChI

InChI=1S/C13H16N2O2S/c1-3-9-14-13(18)15-11-7-5-10(6-8-11)12(16)17-4-2/h3,5-8H,1,4,9H2,2H3,(H2,14,15,18)