3-(ethylcarbamoyl)-2-[(4-methoxyphenyl)methylsulfanyl]-6-methyl-4-(3-nitrophenyl)-4H-pyrimidine-5-carboxylic acid

Systemtic Name: 3-(ethylcarbamoyl)-2-[(4-methoxyphenyl)methylsulfanyl]-6-methyl-4-(3-nitrophenyl)-4H-pyrimidine-5-carboxylic acid Openeye Name: 3-(ethylcarbamoyl)-2-[(4-methoxyphenyl)methylsulfanyl]-6-methyl-4-(3-nitrophenyl)-4H-pyrimidine-5-carboxylic acid CAS Name: 3-(ethylcarbamoyl)-2-[(4-methoxyphenyl)methylthio]-6-methyl-4-(3-nitrophenyl)-4H-pyrimidine-5-carboxylic acid IUPAC Name: 3-(ethylcarbamoyl)-2-[(4-methoxyphenyl)methylsulfanyl]-6-methyl-4-(3-nitrophenyl)-4H-pyrimidine-5-carboxylic acid Traditional Name: 3-(ethylcarbamoyl)-6-methyl-4-(3-nitrophenyl)-2-(p-anisylthio)-4H-pyrimidine-5-carboxylic acid Formula: C23H24N4O6S MolecularWeight: 484.52486

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)N1C(C(=C(N=C1SCC2=CC=C(C=C2)OC)C)C(=O)O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CCNC(=O)N1C(C(=C(N=C1SCC2=CC=C(C=C2)OC)C)C(=O)O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C23H24N4O6S/c1-4-24-22(30)26-20(16-6-5-7-17(12-16)27(31)32)19(21(28)29)14(2)25-23(26)34-13-15-8-10-18(33-3)11-9-15/h5-12,20H,4,13H2,1-3H3,(H,24,30)(H,28,29)