2-(1,3-benzoxazol-2-ylsulfanyl)-1-(1H-pyrrol-2-yl)ethanone

Systemtic Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-1-(1H-pyrrol-2-yl)ethanone Openeye Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-1-(1H-pyrrol-2-yl)ethanone CAS Name: 2-(1,3-benzoxazol-2-ylthio)-1-(1H-pyrrol-2-yl)ethanone IUPAC Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-1-(1H-pyrrol-2-yl)ethanone Traditional Name: 2-(1,3-benzoxazol-2-ylthio)-1-(1H-pyrrol-2-yl)ethanone Formula: C13H10N2O2S MolecularWeight: 258.2957

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(O2)SCC(=O)C3=CC=CN3

Isomeric SMILES

C1=CC=C2C(=C1)N=C(O2)SCC(=O)C3=CC=CN3

InChI

InChI=1S/C13H10N2O2S/c16-11(9-5-3-7-14-9)8-18-13-15-10-4-1-2-6-12(10)17-13/h1-7,14H,8H2