1-[2-(2,1,3-benzoxadiazol-5-ylcarbonyl)pyrazolidin-1-yl]-3-methylsulfanyl-propan-1-one

Systemtic Name: 1-[2-(2,1,3-benzoxadiazol-5-ylcarbonyl)pyrazolidin-1-yl]-3-methylsulfanyl-propan-1-one Openeye Name: 1-[2-(2,1,3-benzoxadiazole-5-carbonyl)pyrazolidin-1-yl]-3-methylsulfanyl-propan-1-one CAS Name: 1-[2-[2,1,3-benzoxadiazol-5-yl(oxo)methyl]-1-pyrazolidinyl]-3-(methylthio)-1-propanone IUPAC Name: 1-[2-(2,1,3-benzoxadiazole-5-carbonyl)pyrazolidin-1-yl]-3-methylsulfanylpropan-1-one Traditional Name: 1-[2-(benzofurazan-5-carbonyl)pyrazolidin-1-yl]-3-(methylthio)propan-1-one Formula: C14H16N4O3S MolecularWeight: 320.36684

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSCCC(=O)N1CCCN1C(=O)C2=CC3=NON=C3C=C2

Isomeric SMILES

CSCCC(=O)N1CCCN1C(=O)C2=CC3=NON=C3C=C2

InChI

InChI=1S/C14H16N4O3S/c1-22-8-5-13(19)17-6-2-7-18(17)14(20)10-3-4-11-12(9-10)16-21-15-11/h3-4,9H,2,5-8H2,1H3