N-[1-[2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl]pyrazol-4-yl]-5-methylsulfanyl-thiophene-2-carboxamide

Systemtic Name: N-[1-[2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl]pyrazol-4-yl]-5-methylsulfanyl-thiophene-2-carboxamide Openeye Name: N-[1-[2-(1,3-dioxoisoindolin-2-yl)ethyl]pyrazol-4-yl]-5-methylsulfanyl-thiophene-2-carboxamide CAS Name: N-[1-[2-(1,3-dioxo-2-isoindolyl)ethyl]-4-pyrazolyl]-5-(methylthio)-2-thiophenecarboxamide IUPAC Name: N-[1-[2-(1,3-dioxoisoindol-2-yl)ethyl]pyrazol-4-yl]-5-methylsulfanylthiophene-2-carboxamide Traditional Name: 5-(methylthio)-N-[1-(2-phthalimidoethyl)pyrazol-4-yl]thiophene-2-carboxamide Formula: C19H16N4O3S2 MolecularWeight: 412.48534

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(S1)C(=O)NC2=CN(N=C2)CCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CSC1=CC=C(S1)C(=O)NC2=CN(N=C2)CCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C19H16N4O3S2/c1-27-16-7-6-15(28-16)17(24)21-12-10-20-22(11-12)8-9-23-18(25)13-4-2-3-5-14(13)19(23)26/h2-7,10-11H,8-9H2,1H3,(H,21,24)