ethyl 4-[2-[(3-methoxyphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-6-methyl-2-phenyl-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-[2-[(3-methoxyphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-6-methyl-2-phenyl-pyrimidine-5-carboxylate Openeye Name: ethyl 4-[2-(3-methoxyanilino)-2-oxo-ethyl]sulfanyl-6-methyl-2-phenyl-pyrimidine-5-carboxylate CAS Name: 4-[[2-(3-methoxyanilino)-2-oxoethyl]thio]-6-methyl-2-phenyl-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-(3-methoxyanilino)-2-oxoethyl]sulfanyl-6-methyl-2-phenylpyrimidine-5-carboxylate Traditional Name: 4-[[2-keto-2-(m-anisidino)ethyl]thio]-6-methyl-2-phenyl-pyrimidine-5-carboxylic acid ethyl ester Formula: C23H23N3O4S MolecularWeight: 437.51142

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(N=C1SCC(=O)NC2=CC(=CC=C2)OC)C3=CC=CC=C3)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(N=C1SCC(=O)NC2=CC(=CC=C2)OC)C3=CC=CC=C3)C

InChI

InChI=1S/C23H23N3O4S/c1-4-30-23(28)20-15(2)24-21(16-9-6-5-7-10-16)26-22(20)31-14-19(27)25-17-11-8-12-18(13-17)29-3/h5-13H,4,14H2,1-3H3,(H,25,27)