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

Systemtic Name: prop-2-enyl 2-[[3-(4-ethoxy-3-nitro-phenyl)-1-phenyl-pyrazol-4-yl]methylidene]-5-(4-methoxycarbonylphenyl)-7-methyl-3-oxidanylidene-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate Openeye Name: allyl 2-[[3-(4-ethoxy-3-nitro-phenyl)-1-phenyl-pyrazol-4-yl]methylene]-5-(4-methoxycarbonylphenyl)-7-methyl-3-oxo-5H-thiazolo[3,2-a]pyrimidine-6-carboxylate CAS Name: 2-[[3-(4-ethoxy-3-nitrophenyl)-1-phenyl-4-pyrazolyl]methylidene]-5-(4-methoxycarbonylphenyl)-7-methyl-3-oxo-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl 2-[[3-(4-ethoxy-3-nitrophenyl)-1-phenylpyrazol-4-yl]methylidene]-5-(4-methoxycarbonylphenyl)-7-methyl-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate Traditional Name: 5-(4-carbomethoxyphenyl)-2-[[3-(4-ethoxy-3-nitro-phenyl)-1-phenyl-pyrazol-4-yl]methylene]-3-keto-7-methyl-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid allyl ester Formula: C37H31N5O8S MolecularWeight: 705.73574

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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)C(=O)OC)C6=CC=CC=C6)[N+](=O)[O-]

Isomeric 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)C(=O)OC)C6=CC=CC=C6)[N+](=O)[O-]

InChI

InChI=1S/C37H31N5O8S/c1-5-18-50-36(45)31-22(3)38-37-41(33(31)23-12-14-24(15-13-23)35(44)48-4)34(43)30(51-37)20-26-21-40(27-10-8-7-9-11-27)39-32(26)25-16-17-29(49-6-2)28(19-25)42(46)47/h5,7-17,19-21,33H,1,6,18H2,2-4H3