2-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-(2-cyclopentylpyrazol-3-yl)-4-methylsulfanyl-butanamide

Systemtic Name: 2-[1,3-bis(oxidanylidene)isoindol-2-yl]-N-(2-cyclopentylpyrazol-3-yl)-4-methylsulfanyl-butanamide Openeye Name: N-(2-cyclopentylpyrazol-3-yl)-2-(1,3-dioxoisoindolin-2-yl)-4-methylsulfanyl-butanamide CAS Name: N-(2-cyclopentyl-3-pyrazolyl)-2-(1,3-dioxo-2-isoindolyl)-4-(methylthio)butanamide IUPAC Name: N-(2-cyclopentylpyrazol-3-yl)-2-(1,3-dioxoisoindol-2-yl)-4-methylsulfanylbutanamide Traditional Name: N-(2-cyclopentylpyrazol-3-yl)-4-(methylthio)-2-phthalimido-butyramide Formula: C21H24N4O3S MolecularWeight: 412.50526

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)NC1=CC=NN1C2CCCC2)N3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CSCCC(C(=O)NC1=CC=NN1C2CCCC2)N3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C21H24N4O3S/c1-29-13-11-17(24-20(27)15-8-4-5-9-16(15)21(24)28)19(26)23-18-10-12-22-25(18)14-6-2-3-7-14/h4-5,8-10,12,14,17H,2-3,6-7,11,13H2,1H3,(H,23,26)