ethyl (2Z,5S)-2-[[1-(4-bromophenyl)-2,5-diphenyl-pyrrol-3-yl]methylidene]-5-(2-chlorophenyl)-7-methyl-3-oxidanylidene-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

Systemtic Name: ethyl (2Z,5S)-2-[[1-(4-bromophenyl)-2,5-diphenyl-pyrrol-3-yl]methylidene]-5-(2-chlorophenyl)-7-methyl-3-oxidanylidene-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate Openeye Name: ethyl (2Z,5S)-2-[[1-(4-bromophenyl)-2,5-diphenyl-pyrrol-3-yl]methylene]-5-(2-chlorophenyl)-7-methyl-3-oxo-5H-thiazolo[3,2-a]pyrimidine-6-carboxylate CAS Name: (2Z,5S)-2-[[1-(4-bromophenyl)-2,5-diphenyl-3-pyrrolyl]methylidene]-5-(2-chlorophenyl)-7-methyl-3-oxo-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid ethyl ester IUPAC Name: ethyl (2Z,5S)-2-[[1-(4-bromophenyl)-2,5-diphenylpyrrol-3-yl]methylidene]-5-(2-chlorophenyl)-7-methyl-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate Traditional Name: (2Z,5S)-2-[[1-(4-bromophenyl)-2,5-diphenyl-pyrrol-3-yl]methylene]-5-(2-chlorophenyl)-3-keto-7-methyl-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid ethyl ester Formula: C39H29BrClN3O3S MolecularWeight: 735.08786

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C2N(C1C3=CC=CC=C3Cl)C(=O)C(=CC4=C(N(C(=C4)C5=CC=CC=C5)C6=CC=C(C=C6)Br)C7=CC=CC=C7)S2)C

Isomeric SMILES

CCOC(=O)C1=C(N=C2N([C@@H]1C3=CC=CC=C3Cl)C(=O)/C(=C/C4=C(N(C(=C4)C5=CC=CC=C5)C6=CC=C(C=C6)Br)C7=CC=CC=C7)/S2)C

InChI

InChI=1S/C39H29BrClN3O3S/c1-3-47-38(46)34-24(2)42-39-44(36(34)30-16-10-11-17-31(30)41)37(45)33(48-39)23-27-22-32(25-12-6-4-7-13-25)43(29-20-18-28(40)19-21-29)35(27)26-14-8-5-9-15-26/h4-23,36H,3H2,1-2H3/b33-23-/t36-/m1/s1