ethyl 2-[[4-(dimethylamino)-3-nitro-phenyl]methylidene]-7-methyl-3-oxidanylidene-5-(4-propan-2-ylphenyl)-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

Systemtic Name: ethyl 2-[[4-(dimethylamino)-3-nitro-phenyl]methylidene]-7-methyl-3-oxidanylidene-5-(4-propan-2-ylphenyl)-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate Openeye Name: ethyl 2-[[4-(dimethylamino)-3-nitro-phenyl]methylene]-5-(4-isopropylphenyl)-7-methyl-3-oxo-5H-thiazolo[3,2-a]pyrimidine-6-carboxylate CAS Name: 2-[[4-(dimethylamino)-3-nitrophenyl]methylidene]-7-methyl-3-oxo-5-(4-propan-2-ylphenyl)-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[[4-(dimethylamino)-3-nitrophenyl]methylidene]-7-methyl-3-oxo-5-(4-propan-2-ylphenyl)-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate Traditional Name: 2-[4-(dimethylamino)-3-nitro-benzylidene]-3-keto-7-methyl-5-p-cumenyl-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid ethyl ester Formula: C28H30N4O5S MolecularWeight: 534.6266

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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(=O)C(=CC4=CC(=C(C=C4)N(C)C)[N+](=O)[O-])S2)C

Isomeric SMILES

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

InChI

InChI=1S/C28H30N4O5S/c1-7-37-27(34)24-17(4)29-28-31(25(24)20-11-9-19(10-12-20)16(2)3)26(33)23(38-28)15-18-8-13-21(30(5)6)22(14-18)32(35)36/h8-16,25H,7H2,1-6H3