ethyl 4-(diphenylamino)-2-methylsulfanyl-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-(diphenylamino)-2-methylsulfanyl-pyrimidine-5-carboxylate Openeye Name: ethyl 2-methylsulfanyl-4-(N-phenylanilino)pyrimidine-5-carboxylate CAS Name: 2-(methylthio)-4-(N-phenylanilino)-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-methylsulfanyl-4-(N-phenylanilino)pyrimidine-5-carboxylate Traditional Name: 2-(methylthio)-4-(N-phenylanilino)pyrimidine-5-carboxylic acid ethyl ester Formula: C20H19N3O2S MolecularWeight: 365.44876

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N=C1N(C2=CC=CC=C2)C3=CC=CC=C3)SC

Isomeric SMILES

CCOC(=O)C1=CN=C(N=C1N(C2=CC=CC=C2)C3=CC=CC=C3)SC

InChI

InChI=1S/C20H19N3O2S/c1-3-25-19(24)17-14-21-20(26-2)22-18(17)23(15-10-6-4-7-11-15)16-12-8-5-9-13-16/h4-14H,3H2,1-2H3