tert-butyl N-[[3-methyl-6-oxidanyl-4-oxidanylidene-5-(3-phenoxyphenyl)-7H-thieno[2,3-b]pyridin-2-yl]methyl]carbamate

Systemtic Name: tert-butyl N-[[3-methyl-6-oxidanyl-4-oxidanylidene-5-(3-phenoxyphenyl)-7H-thieno[2,3-b]pyridin-2-yl]methyl]carbamate Openeye Name: tert-butyl N-[[6-hydroxy-3-methyl-4-oxo-5-(3-phenoxyphenyl)-7H-thieno[2,3-b]pyridin-2-yl]methyl]carbamate CAS Name: N-[[6-hydroxy-3-methyl-4-oxo-5-(3-phenoxyphenyl)-7H-thieno[2,3-b]pyridin-2-yl]methyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[[6-hydroxy-3-methyl-4-oxo-5-(3-phenoxyphenyl)-7H-thieno[2,3-b]pyridin-2-yl]methyl]carbamate Traditional Name: N-[[6-hydroxy-4-keto-3-methyl-5-(3-phenoxyphenyl)-7H-thieno[2,3-b]pyridin-2-yl]methyl]carbamic acid tert-butyl ester Formula: C26H26N2O5S MolecularWeight: 478.56004

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)C(=C(N2)O)C3=CC(=CC=C3)OC4=CC=CC=C4)CNC(=O)OC(C)(C)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)C(=C(N2)O)C3=CC(=CC=C3)OC4=CC=CC=C4)CNC(=O)OC(C)(C)C

InChI

InChI=1S/C26H26N2O5S/c1-15-19(14-27-25(31)33-26(2,3)4)34-24-20(15)22(29)21(23(30)28-24)16-9-8-12-18(13-16)32-17-10-6-5-7-11-17/h5-13H,14H2,1-4H3,(H,27,31)(H2,28,29,30)