ethyl 2-methylsulfanyl-4-(naphthalen-1-ylamino)pyrimidine-5-carboxylate

Systemtic Name: ethyl 2-methylsulfanyl-4-(naphthalen-1-ylamino)pyrimidine-5-carboxylate Openeye Name: ethyl 2-methylsulfanyl-4-(1-naphthylamino)pyrimidine-5-carboxylate CAS Name: 2-(methylthio)-4-(1-naphthalenylamino)-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-methylsulfanyl-4-(naphthalen-1-ylamino)pyrimidine-5-carboxylate Traditional Name: 2-(methylthio)-4-(1-naphthylamino)pyrimidine-5-carboxylic acid ethyl ester Formula: C18H17N3O2S MolecularWeight: 339.41148

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N=C1NC2=CC=CC3=CC=CC=C32)SC

Isomeric SMILES

CCOC(=O)C1=CN=C(N=C1NC2=CC=CC3=CC=CC=C32)SC

InChI

InChI=1S/C18H17N3O2S/c1-3-23-17(22)14-11-19-18(24-2)21-16(14)20-15-10-6-8-12-7-4-5-9-13(12)15/h4-11H,3H2,1-2H3,(H,19,20,21)