5-chloranyl-N-[1-oxidanyl-3-oxidanylidene-2-[[3-[(pyridin-4-ylamino)methyl]phenyl]methyl]-1H-isoindol-4-yl]thiophene-2-carboxamide

Systemtic Name: 5-chloranyl-N-[1-oxidanyl-3-oxidanylidene-2-[[3-[(pyridin-4-ylamino)methyl]phenyl]methyl]-1H-isoindol-4-yl]thiophene-2-carboxamide Openeye Name: 5-chloro-N-[1-hydroxy-3-oxo-2-[[3-[(4-pyridylamino)methyl]phenyl]methyl]isoindolin-4-yl]thiophene-2-carboxamide CAS Name: 5-chloro-N-[1-hydroxy-3-oxo-2-[[3-[(pyridin-4-ylamino)methyl]phenyl]methyl]-1H-isoindol-4-yl]-2-thiophenecarboxamide IUPAC Name: 5-chloro-N-[1-hydroxy-3-oxo-2-[[3-[(pyridin-4-ylamino)methyl]phenyl]methyl]-1H-isoindol-4-yl]thiophene-2-carboxamide Traditional Name: 5-chloro-N-[1-hydroxy-3-keto-2-[3-[(4-pyridylamino)methyl]benzyl]isoindolin-4-yl]thiophene-2-carboxamide Formula: C26H21ClN4O3S MolecularWeight: 504.98794

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)CNC2=CC=NC=C2)CN3C(C4=C(C3=O)C(=CC=C4)NC(=O)C5=CC=C(S5)Cl)O

Isomeric SMILES

C1=CC(=CC(=C1)CNC2=CC=NC=C2)CN3C(C4=C(C3=O)C(=CC=C4)NC(=O)C5=CC=C(S5)Cl)O

InChI

InChI=1S/C26H21ClN4O3S/c27-22-8-7-21(35-22)24(32)30-20-6-2-5-19-23(20)26(34)31(25(19)33)15-17-4-1-3-16(13-17)14-29-18-9-11-28-12-10-18/h1-13,25,33H,14-15H2,(H,28,29)(H,30,32)