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

Systemtic Name: 5-chloranyl-N-[1-methoxy-3-oxidanylidene-2-[[3-[(pyridin-2-ylamino)methyl]phenyl]methyl]-1H-isoindol-4-yl]thiophene-2-carboxamide Openeye Name: 5-chloro-N-[1-methoxy-3-oxo-2-[[3-[(2-pyridylamino)methyl]phenyl]methyl]isoindolin-4-yl]thiophene-2-carboxamide CAS Name: 5-chloro-N-[1-methoxy-3-oxo-2-[[3-[(2-pyridinylamino)methyl]phenyl]methyl]-1H-isoindol-4-yl]-2-thiophenecarboxamide IUPAC Name: 5-chloro-N-[1-methoxy-3-oxo-2-[[3-[(pyridin-2-ylamino)methyl]phenyl]methyl]-1H-isoindol-4-yl]thiophene-2-carboxamide Traditional Name: 5-chloro-N-[3-keto-1-methoxy-2-[3-[(2-pyridylamino)methyl]benzyl]isoindolin-4-yl]thiophene-2-carboxamide Formula: C27H23ClN4O3S MolecularWeight: 519.01452

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1C2=C(C(=CC=C2)NC(=O)C3=CC=C(S3)Cl)C(=O)N1CC4=CC(=CC=C4)CNC5=CC=CC=N5

Isomeric SMILES

COC1C2=C(C(=CC=C2)NC(=O)C3=CC=C(S3)Cl)C(=O)N1CC4=CC(=CC=C4)CNC5=CC=CC=N5

InChI

InChI=1S/C27H23ClN4O3S/c1-35-27-19-8-5-9-20(31-25(33)21-11-12-22(28)36-21)24(19)26(34)32(27)16-18-7-4-6-17(14-18)15-30-23-10-2-3-13-29-23/h2-14,27H,15-16H2,1H3,(H,29,30)(H,31,33)