phenyl (2E)-2-[[3-bromanyl-4-[2-(3,4-dimethylphenoxy)ethoxy]-5-methoxy-phenyl]methylidene]-7-methyl-3-oxidanylidene-5-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

Systemtic Name: phenyl (2E)-2-[[3-bromanyl-4-[2-(3,4-dimethylphenoxy)ethoxy]-5-methoxy-phenyl]methylidene]-7-methyl-3-oxidanylidene-5-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate Openeye Name: phenyl (2E)-2-[[3-bromo-4-[2-(3,4-dimethylphenoxy)ethoxy]-5-methoxy-phenyl]methylene]-7-methyl-3-oxo-5-phenyl-5H-thiazolo[3,2-a]pyrimidine-6-carboxylate CAS Name: (2E)-2-[[3-bromo-4-[2-(3,4-dimethylphenoxy)ethoxy]-5-methoxyphenyl]methylidene]-7-methyl-3-oxo-5-phenyl-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid phenyl ester IUPAC Name: phenyl (2E)-2-[[3-bromo-4-[2-(3,4-dimethylphenoxy)ethoxy]-5-methoxyphenyl]methylidene]-7-methyl-3-oxo-5-phenyl-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate Traditional Name: (2E)-2-[3-bromo-4-[2-(3,4-dimethylphenoxy)ethoxy]-5-methoxy-benzylidene]-3-keto-7-methyl-5-phenyl-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid phenyl ester Formula: C38H33BrN2O6S MolecularWeight: 725.64742

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)OCCOC2=C(C=C(C=C2Br)C=C3C(=O)N4C(C(=C(N=C4S3)C)C(=O)OC5=CC=CC=C5)C6=CC=CC=C6)OC)C

Isomeric SMILES

CC1=C(C=C(C=C1)OCCOC2=C(C=C(C=C2Br)/C=C/3\C(=O)N4C(C(=C(N=C4S3)C)C(=O)OC5=CC=CC=C5)C6=CC=CC=C6)OC)C

InChI

InChI=1S/C38H33BrN2O6S/c1-23-15-16-29(19-24(23)2)45-17-18-46-35-30(39)20-26(21-31(35)44-4)22-32-36(42)41-34(27-11-7-5-8-12-27)33(25(3)40-38(41)48-32)37(43)47-28-13-9-6-10-14-28/h5-16,19-22,34H,17-18H2,1-4H3/b32-22+