ethyl 2-(2-azanyl-6-chloranyl-5-methanoyl-pyrimidin-4-yl)sulfanylethanoate

Systemtic Name: ethyl 2-(2-azanyl-6-chloranyl-5-methanoyl-pyrimidin-4-yl)sulfanylethanoate Openeye Name: ethyl 2-(2-amino-6-chloro-5-formyl-pyrimidin-4-yl)sulfanylacetate CAS Name: 2-[(2-amino-6-chloro-5-formyl-4-pyrimidinyl)thio]acetic acid ethyl ester IUPAC Name: ethyl 2-(2-amino-6-chloro-5-formylpyrimidin-4-yl)sulfanylacetate Traditional Name: 2-[(2-amino-6-chloro-5-formyl-pyrimidin-4-yl)thio]acetic acid ethyl ester Formula: C9H10ClN3O3S MolecularWeight: 275.712

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=C(C(=NC(=N1)N)Cl)C=O

Isomeric SMILES

CCOC(=O)CSC1=C(C(=NC(=N1)N)Cl)C=O

InChI

InChI=1S/C9H10ClN3O3S/c1-2-16-6(15)4-17-8-5(3-14)7(10)12-9(11)13-8/h3H,2,4H2,1H3,(H2,11,12,13)