2-(1,3-benzoxazol-2-ylsulfanyl)-N-(prop-2-enylcarbamothioyl)ethanamide

Systemtic Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-N-(prop-2-enylcarbamothioyl)ethanamide Openeye Name: N-(allylcarbamothioyl)-2-(1,3-benzoxazol-2-ylsulfanyl)acetamide CAS Name: 2-(1,3-benzoxazol-2-ylthio)-N-[(prop-2-enylamino)-sulfanylidenemethyl]acetamide IUPAC Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-N-(prop-2-enylcarbamothioyl)acetamide Traditional Name: N-(allylthiocarbamoyl)-2-(1,3-benzoxazol-2-ylthio)acetamide Formula: C13H13N3O2S2 MolecularWeight: 307.39122

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=S)NC(=O)CSC1=NC2=CC=CC=C2O1

Isomeric SMILES

C=CCNC(=S)NC(=O)CSC1=NC2=CC=CC=C2O1

InChI

InChI=1S/C13H13N3O2S2/c1-2-7-14-12(19)16-11(17)8-20-13-15-9-5-3-4-6-10(9)18-13/h2-6H,1,7-8H2,(H2,14,16,17,19)