ethyl 1,6-dimethyl-3-(4-methylphenyl)sulfonyl-4-(3-nitrophenyl)-2-oxidanylidene-4H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 1,6-dimethyl-3-(4-methylphenyl)sulfonyl-4-(3-nitrophenyl)-2-oxidanylidene-4H-pyrimidine-5-carboxylate Openeye Name: ethyl 1,6-dimethyl-4-(3-nitrophenyl)-2-oxo-3-(p-tolylsulfonyl)-4H-pyrimidine-5-carboxylate CAS Name: 1,6-dimethyl-3-(4-methylphenyl)sulfonyl-4-(3-nitrophenyl)-2-oxo-4H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 1,6-dimethyl-3-(4-methylphenyl)sulfonyl-4-(3-nitrophenyl)-2-oxo-4H-pyrimidine-5-carboxylate Traditional Name: 2-keto-1,6-dimethyl-4-(3-nitrophenyl)-3-tosyl-4H-pyrimidine-5-carboxylic acid ethyl ester Formula: C22H23N3O7S MolecularWeight: 473.49892

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=O)N(C1C2=CC(=CC=C2)[N+](=O)[O-])S(=O)(=O)C3=CC=C(C=C3)C)C)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=O)N(C1C2=CC(=CC=C2)[N+](=O)[O-])S(=O)(=O)C3=CC=C(C=C3)C)C)C

InChI

InChI=1S/C22H23N3O7S/c1-5-32-21(26)19-15(3)23(4)22(27)24(33(30,31)18-11-9-14(2)10-12-18)20(19)16-7-6-8-17(13-16)25(28)29/h6-13,20H,5H2,1-4H3