ethyl 5-(4-tert-butylphenyl)-7-methyl-2-[[5-(2-nitrophenyl)furan-3-yl]methylidene]-3-oxidanylidene-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

Systemtic Name: ethyl 5-(4-tert-butylphenyl)-7-methyl-2-[[5-(2-nitrophenyl)furan-3-yl]methylidene]-3-oxidanylidene-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate Openeye Name: ethyl 5-(4-tert-butylphenyl)-7-methyl-2-[[5-(2-nitrophenyl)-3-furyl]methylene]-3-oxo-5H-thiazolo[3,2-a]pyrimidine-6-carboxylate CAS Name: 5-(4-tert-butylphenyl)-7-methyl-2-[[5-(2-nitrophenyl)-3-furanyl]methylidene]-3-oxo-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid ethyl ester IUPAC Name: ethyl 5-(4-tert-butylphenyl)-7-methyl-2-[[5-(2-nitrophenyl)furan-3-yl]methylidene]-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate Traditional Name: 5-(4-tert-butylphenyl)-3-keto-7-methyl-2-[[5-(2-nitrophenyl)-3-furyl]methylene]-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid ethyl ester Formula: C31H29N3O6S MolecularWeight: 571.64346

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C2N(C1C3=CC=C(C=C3)C(C)(C)C)C(=O)C(=CC4=COC(=C4)C5=CC=CC=C5[N+](=O)[O-])S2)C

Isomeric SMILES

CCOC(=O)C1=C(N=C2N(C1C3=CC=C(C=C3)C(C)(C)C)C(=O)C(=CC4=COC(=C4)C5=CC=CC=C5[N+](=O)[O-])S2)C

InChI

InChI=1S/C31H29N3O6S/c1-6-39-29(36)26-18(2)32-30-33(27(26)20-11-13-21(14-12-20)31(3,4)5)28(35)25(41-30)16-19-15-24(40-17-19)22-9-7-8-10-23(22)34(37)38/h7-17,27H,6H2,1-5H3