ethyl 4-azanyl-2-[(2-ethoxyphenyl)methylsulfanyl]pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-azanyl-2-[(2-ethoxyphenyl)methylsulfanyl]pyrimidine-5-carboxylate Openeye Name: ethyl 4-amino-2-[(2-ethoxyphenyl)methylsulfanyl]pyrimidine-5-carboxylate CAS Name: 4-amino-2-[(2-ethoxyphenyl)methylthio]-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-amino-2-[(2-ethoxyphenyl)methylsulfanyl]pyrimidine-5-carboxylate Traditional Name: 4-amino-2-[(2-ethoxybenzyl)thio]pyrimidine-5-carboxylic acid ethyl ester Formula: C16H19N3O3S MolecularWeight: 333.40536

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1CSC2=NC=C(C(=N2)N)C(=O)OCC

Isomeric SMILES

CCOC1=CC=CC=C1CSC2=NC=C(C(=N2)N)C(=O)OCC

InChI

InChI=1S/C16H19N3O3S/c1-3-21-13-8-6-5-7-11(13)10-23-16-18-9-12(14(17)19-16)15(20)22-4-2/h5-9H,3-4,10H2,1-2H3,(H2,17,18,19)