ethyl 4-azanyl-2-(3-azanyl-3-oxidanylidene-propyl)sulfanyl-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-azanyl-2-(3-azanyl-3-oxidanylidene-propyl)sulfanyl-pyrimidine-5-carboxylate Openeye Name: ethyl 4-amino-2-(3-amino-3-oxo-propyl)sulfanyl-pyrimidine-5-carboxylate CAS Name: 4-amino-2-[(3-amino-3-oxopropyl)thio]-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-amino-2-(3-amino-3-oxopropyl)sulfanylpyrimidine-5-carboxylate Traditional Name: 4-amino-2-[(3-amino-3-keto-propyl)thio]pyrimidine-5-carboxylic acid ethyl ester Formula: C10H14N4O3S MolecularWeight: 270.30816

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H14N4O3S/c1-2-17-9(16)6-5-13-10(14-8(6)12)18-4-3-7(11)15/h5H,2-4H2,1H3,(H2,11,15)(H2,12,13,14)