methyl 2-[[4-[(2-cyanophenyl)methoxy]-3-methoxy-phenyl]methylidene]-7-methyl-3-oxidanylidene-5-thiophen-2-yl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

Systemtic Name: methyl 2-[[4-[(2-cyanophenyl)methoxy]-3-methoxy-phenyl]methylidene]-7-methyl-3-oxidanylidene-5-thiophen-2-yl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate Openeye Name: methyl 2-[[4-[(2-cyanophenyl)methoxy]-3-methoxy-phenyl]methylene]-7-methyl-3-oxo-5-(2-thienyl)-5H-thiazolo[3,2-a]pyrimidine-6-carboxylate CAS Name: 2-[[4-[(2-cyanophenyl)methoxy]-3-methoxyphenyl]methylidene]-7-methyl-3-oxo-5-thiophen-2-yl-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid methyl ester IUPAC Name: methyl 2-[[4-[(2-cyanophenyl)methoxy]-3-methoxyphenyl]methylidene]-7-methyl-3-oxo-5-thiophen-2-yl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate Traditional Name: 2-[4-(2-cyanobenzyl)oxy-3-methoxy-benzylidene]-3-keto-7-methyl-5-(2-thienyl)-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid methyl ester Formula: C29H23N3O5S2 MolecularWeight: 557.64002

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(N2C(=O)C(=CC3=CC(=C(C=C3)OCC4=CC=CC=C4C#N)OC)SC2=N1)C5=CC=CS5)C(=O)OC

Isomeric SMILES

CC1=C(C(N2C(=O)C(=CC3=CC(=C(C=C3)OCC4=CC=CC=C4C#N)OC)SC2=N1)C5=CC=CS5)C(=O)OC

InChI

InChI=1S/C29H23N3O5S2/c1-17-25(28(34)36-3)26(23-9-6-12-38-23)32-27(33)24(39-29(32)31-17)14-18-10-11-21(22(13-18)35-2)37-16-20-8-5-4-7-19(20)15-30/h4-14,26H,16H2,1-3H3