ethyl 3-(2-methylprop-2-enylcarbamothioylamino)benzoate

Systemtic Name: ethyl 3-(2-methylprop-2-enylcarbamothioylamino)benzoate Openeye Name: ethyl 3-(2-methylallylcarbamothioylamino)benzoate CAS Name: 3-[[(2-methylprop-2-enylamino)-sulfanylidenemethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-(2-methylprop-2-enylcarbamothioylamino)benzoate Traditional Name: 3-(2-methylallylthiocarbamoylamino)benzoic acid ethyl ester Formula: C14H18N2O2S MolecularWeight: 278.36992

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H18N2O2S/c1-4-18-13(17)11-6-5-7-12(8-11)16-14(19)15-9-10(2)3/h5-8H,2,4,9H2,1,3H3,(H2,15,16,19)