N-[2-[[3-(cyanomethyl)phenyl]methyl]-1-oxidanylidene-3H-isoindol-4-yl]-5-methyl-thiophene-2-carboxamide

Systemtic Name: N-[2-[[3-(cyanomethyl)phenyl]methyl]-1-oxidanylidene-3H-isoindol-4-yl]-5-methyl-thiophene-2-carboxamide Openeye Name: N-[2-[[3-(cyanomethyl)phenyl]methyl]-1-oxo-isoindolin-4-yl]-5-methyl-thiophene-2-carboxamide CAS Name: N-[2-[[3-(cyanomethyl)phenyl]methyl]-1-oxo-3H-isoindol-4-yl]-5-methyl-2-thiophenecarboxamide IUPAC Name: N-[2-[[3-(cyanomethyl)phenyl]methyl]-1-oxo-3H-isoindol-4-yl]-5-methylthiophene-2-carboxamide Traditional Name: N-[2-[3-(cyanomethyl)benzyl]-1-keto-isoindolin-4-yl]-5-methyl-thiophene-2-carboxamide Formula: C23H19N3O2S MolecularWeight: 401.48086

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C(=O)NC2=CC=CC3=C2CN(C3=O)CC4=CC=CC(=C4)CC#N

Isomeric SMILES

CC1=CC=C(S1)C(=O)NC2=CC=CC3=C2CN(C3=O)CC4=CC=CC(=C4)CC#N

InChI

InChI=1S/C23H19N3O2S/c1-15-8-9-21(29-15)22(27)25-20-7-3-6-18-19(20)14-26(23(18)28)13-17-5-2-4-16(12-17)10-11-24/h2-9,12H,10,13-14H2,1H3,(H,25,27)