ethyl 4-azanyl-2-methanethioyl-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-azanyl-2-methanethioyl-pyrimidine-5-carboxylate Openeye Name: ethyl 4-amino-2-methanethioyl-pyrimidine-5-carboxylate CAS Name: 4-amino-2-methanethioyl-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-amino-2-methanethioylpyrimidine-5-carboxylate Traditional Name: 4-amino-2-thioformyl-pyrimidine-5-carboxylic acid ethyl ester Formula: C8H9N3O2S MolecularWeight: 211.24096

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N=C1N)C=S

Isomeric SMILES

CCOC(=O)C1=CN=C(N=C1N)C=S

InChI

InChI=1S/C8H9N3O2S/c1-2-13-8(12)5-3-10-6(4-14)11-7(5)9/h3-4H,2H2,1H3,(H2,9,10,11)