ethyl 4-azanyl-2-[2-oxidanylidene-2-[(3-propan-2-yl-1,2-oxazol-5-yl)amino]ethyl]sulfanyl-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-azanyl-2-[2-oxidanylidene-2-[(3-propan-2-yl-1,2-oxazol-5-yl)amino]ethyl]sulfanyl-pyrimidine-5-carboxylate Openeye Name: ethyl 4-amino-2-[2-[(3-isopropylisoxazol-5-yl)amino]-2-oxo-ethyl]sulfanyl-pyrimidine-5-carboxylate CAS Name: 4-amino-2-[[2-oxo-2-[(3-propan-2-yl-5-isoxazolyl)amino]ethyl]thio]-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-amino-2-[2-oxo-2-[(3-propan-2-yl-1,2-oxazol-5-yl)amino]ethyl]sulfanylpyrimidine-5-carboxylate Traditional Name: 4-amino-2-[[2-[(3-isopropylisoxazol-5-yl)amino]-2-keto-ethyl]thio]pyrimidine-5-carboxylic acid ethyl ester Formula: C15H19N5O4S MolecularWeight: 365.40746

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N=C1N)SCC(=O)NC2=CC(=NO2)C(C)C

Isomeric SMILES

CCOC(=O)C1=CN=C(N=C1N)SCC(=O)NC2=CC(=NO2)C(C)C

InChI

InChI=1S/C15H19N5O4S/c1-4-23-14(22)9-6-17-15(19-13(9)16)25-7-11(21)18-12-5-10(8(2)3)20-24-12/h5-6,8H,4,7H2,1-3H3,(H,18,21)(H2,16,17,19)