O6-ethyl O8-methyl (2E)-5-azanyl-7-(4-ethoxyphenyl)-2-[(4-ethoxyphenyl)methylidene]-3-oxidanylidene-7H-[1,3]thiazolo[3,2-a]pyridine-6,8-dicarboxylate

Systemtic Name: O6-ethyl O8-methyl (2E)-5-azanyl-7-(4-ethoxyphenyl)-2-[(4-ethoxyphenyl)methylidene]-3-oxidanylidene-7H-[1,3]thiazolo[3,2-a]pyridine-6,8-dicarboxylate Openeye Name: O6-ethyl O8-methyl (2E)-5-amino-7-(4-ethoxyphenyl)-2-[(4-ethoxyphenyl)methylene]-3-oxo-7H-thiazolo[3,2-a]pyridine-6,8-dicarboxylate CAS Name: (2E)-5-amino-7-(4-ethoxyphenyl)-2-[(4-ethoxyphenyl)methylidene]-3-oxo-7H-thiazolo[3,2-a]pyridine-6,8-dicarboxylic acid O6-ethyl ester O8-methyl ester IUPAC Name: 6-O-ethyl 8-O-methyl (2E)-5-amino-7-(4-ethoxyphenyl)-2-[(4-ethoxyphenyl)methylidene]-3-oxo-7H-[1,3]thiazolo[3,2-a]pyridine-6,8-dicarboxylate Traditional Name: (2E)-5-amino-2-(4-ethoxybenzylidene)-3-keto-7-p-phenetyl-7H-thiazolo[3,2-a]pyridine-6,8-dicarboxylic acid O6-ethyl ester O8-methyl ester Formula: C29H30N2O7S MolecularWeight: 550.6227

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C=C2C(=O)N3C(=C(C(C(=C3S2)C(=O)OC)C4=CC=C(C=C4)OCC)C(=O)OCC)N

Isomeric SMILES

CCOC1=CC=C(C=C1)/C=C/2\C(=O)N3C(=C(C(C(=C3S2)C(=O)OC)C4=CC=C(C=C4)OCC)C(=O)OCC)N

InChI

InChI=1S/C29H30N2O7S/c1-5-36-19-12-8-17(9-13-19)16-21-26(32)31-25(30)23(29(34)38-7-3)22(24(27(31)39-21)28(33)35-4)18-10-14-20(15-11-18)37-6-2/h8-16,22H,5-7,30H2,1-4H3/b21-16+