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

Systemtic Name: ethyl 2-methylsulfanyl-4-(phenacylamino)pyrimidine-5-carboxylate Openeye Name: ethyl 2-methylsulfanyl-4-(phenacylamino)pyrimidine-5-carboxylate CAS Name: 2-(methylthio)-4-(phenacylamino)-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-methylsulfanyl-4-(phenacylamino)pyrimidine-5-carboxylate Traditional Name: 2-(methylthio)-4-(phenacylamino)pyrimidine-5-carboxylic acid ethyl ester Formula: C16H17N3O3S MolecularWeight: 331.38948

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N=C1NCC(=O)C2=CC=CC=C2)SC

Isomeric SMILES

CCOC(=O)C1=CN=C(N=C1NCC(=O)C2=CC=CC=C2)SC

InChI

InChI=1S/C16H17N3O3S/c1-3-22-15(21)12-9-18-16(23-2)19-14(12)17-10-13(20)11-7-5-4-6-8-11/h4-9H,3,10H2,1-2H3,(H,17,18,19)