prop-2-enyl (2Z)-5-(4-acetyloxy-3-methoxy-phenyl)-2-[[3-(4-ethoxy-3-methyl-phenyl)-1-phenyl-pyrazol-4-yl]methylidene]-7-methyl-3-oxidanylidene-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

Systemtic Name: prop-2-enyl (2Z)-5-(4-acetyloxy-3-methoxy-phenyl)-2-[[3-(4-ethoxy-3-methyl-phenyl)-1-phenyl-pyrazol-4-yl]methylidene]-7-methyl-3-oxidanylidene-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate Openeye Name: allyl (2Z)-5-(4-acetoxy-3-methoxy-phenyl)-2-[[3-(4-ethoxy-3-methyl-phenyl)-1-phenyl-pyrazol-4-yl]methylene]-7-methyl-3-oxo-5H-thiazolo[3,2-a]pyrimidine-6-carboxylate CAS Name: (2Z)-5-(4-acetyloxy-3-methoxyphenyl)-2-[[3-(4-ethoxy-3-methylphenyl)-1-phenyl-4-pyrazolyl]methylidene]-7-methyl-3-oxo-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl (2Z)-5-(4-acetyloxy-3-methoxyphenyl)-2-[[3-(4-ethoxy-3-methylphenyl)-1-phenylpyrazol-4-yl]methylidene]-7-methyl-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate Traditional Name: (2Z)-5-(4-acetoxy-3-methoxy-phenyl)-2-[[3-(4-ethoxy-3-methyl-phenyl)-1-phenyl-pyrazol-4-yl]methylene]-3-keto-7-methyl-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid allyl ester Formula: C39H36N4O7S MolecularWeight: 704.79074

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C2=NN(C=C2C=C3C(=O)N4C(C(=C(N=C4S3)C)C(=O)OCC=C)C5=CC(=C(C=C5)OC(=O)C)OC)C6=CC=CC=C6)C

Isomeric SMILES

CCOC1=C(C=C(C=C1)C2=NN(C=C2/C=C\3/C(=O)N4C(C(=C(N=C4S3)C)C(=O)OCC=C)C5=CC(=C(C=C5)OC(=O)C)OC)C6=CC=CC=C6)C

InChI

InChI=1S/C39H36N4O7S/c1-7-18-49-38(46)34-24(4)40-39-43(36(34)27-15-17-31(50-25(5)44)32(20-27)47-6)37(45)33(51-39)21-28-22-42(29-12-10-9-11-13-29)41-35(28)26-14-16-30(48-8-2)23(3)19-26/h7,9-17,19-22,36H,1,8,18H2,2-6H3/b33-21-