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

Systemtic Name: 5-chloranyl-N-[2-[[3-(cyanomethyl)cyclohexyl]methyl]-3-oxidanylidene-1H-isoindol-4-yl]thiophene-2-carboxamide Openeye Name: 5-chloro-N-[2-[[3-(cyanomethyl)cyclohexyl]methyl]-3-oxo-isoindolin-4-yl]thiophene-2-carboxamide CAS Name: 5-chloro-N-[2-[[3-(cyanomethyl)cyclohexyl]methyl]-3-oxo-1H-isoindol-4-yl]-2-thiophenecarboxamide IUPAC Name: 5-chloro-N-[2-[[3-(cyanomethyl)cyclohexyl]methyl]-3-oxo-1H-isoindol-4-yl]thiophene-2-carboxamide Traditional Name: 5-chloro-N-[2-[[3-(cyanomethyl)cyclohexyl]methyl]-3-keto-isoindolin-4-yl]thiophene-2-carboxamide Formula: C22H22ClN3O2S MolecularWeight: 427.94698

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CC(C1)CN2CC3=C(C2=O)C(=CC=C3)NC(=O)C4=CC=C(S4)Cl)CC#N

Isomeric SMILES

C1CC(CC(C1)CN2CC3=C(C2=O)C(=CC=C3)NC(=O)C4=CC=C(S4)Cl)CC#N

InChI

InChI=1S/C22H22ClN3O2S/c23-19-8-7-18(29-19)21(27)25-17-6-2-5-16-13-26(22(28)20(16)17)12-15-4-1-3-14(11-15)9-10-24/h2,5-8,14-15H,1,3-4,9,11-13H2,(H,25,27)