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

Systemtic Name: ethyl 4-methyl-6-[2-[(3-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-2-phenyl-pyrimidine-5-carboxylate Openeye Name: ethyl 4-methyl-6-[2-(3-methylanilino)-2-oxo-ethyl]sulfanyl-2-phenyl-pyrimidine-5-carboxylate CAS Name: 4-methyl-6-[[2-(3-methylanilino)-2-oxoethyl]thio]-2-phenyl-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-methyl-6-[2-(3-methylanilino)-2-oxoethyl]sulfanyl-2-phenylpyrimidine-5-carboxylate Traditional Name: 4-[[2-keto-2-(m-toluidino)ethyl]thio]-6-methyl-2-phenyl-pyrimidine-5-carboxylic acid ethyl ester Formula: C23H23N3O3S MolecularWeight: 421.51202

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H23N3O3S/c1-4-29-23(28)20-16(3)24-21(17-10-6-5-7-11-17)26-22(20)30-14-19(27)25-18-12-8-9-15(2)13-18/h5-13H,4,14H2,1-3H3,(H,25,27)