2-methylpropyl 2-ethyl-7-methyl-5-(4-nitrophenyl)-3-oxidanylidene-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

Systemtic Name: 2-methylpropyl 2-ethyl-7-methyl-5-(4-nitrophenyl)-3-oxidanylidene-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate Openeye Name: isobutyl 2-ethyl-7-methyl-5-(4-nitrophenyl)-3-oxo-5H-thiazolo[3,2-a]pyrimidine-6-carboxylate CAS Name: 2-ethyl-7-methyl-5-(4-nitrophenyl)-3-oxo-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 2-ethyl-7-methyl-5-(4-nitrophenyl)-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate Traditional Name: 2-ethyl-3-keto-7-methyl-5-(4-nitrophenyl)-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid isobutyl ester Formula: C20H23N3O5S MolecularWeight: 417.47872

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=O)N2C(C(=C(N=C2S1)C)C(=O)OCC(C)C)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCC1C(=O)N2C(C(=C(N=C2S1)C)C(=O)OCC(C)C)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H23N3O5S/c1-5-15-18(24)22-17(13-6-8-14(9-7-13)23(26)27)16(12(4)21-20(22)29-15)19(25)28-10-11(2)3/h6-9,11,15,17H,5,10H2,1-4H3