ethyl 2-[6-(4-nitrophenoxy)pyrimidin-4-yl]sulfanylethanoate

Systemtic Name: ethyl 2-[6-(4-nitrophenoxy)pyrimidin-4-yl]sulfanylethanoate Openeye Name: ethyl 2-[6-(4-nitrophenoxy)pyrimidin-4-yl]sulfanylacetate CAS Name: 2-[[6-(4-nitrophenoxy)-4-pyrimidinyl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[6-(4-nitrophenoxy)pyrimidin-4-yl]sulfanylacetate Traditional Name: 2-[[6-(4-nitrophenoxy)pyrimidin-4-yl]thio]acetic acid ethyl ester Formula: C14H13N3O5S MolecularWeight: 335.33512

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=NC=NC(=C1)OC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)CSC1=NC=NC(=C1)OC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C14H13N3O5S/c1-2-21-14(18)8-23-13-7-12(15-9-16-13)22-11-5-3-10(4-6-11)17(19)20/h3-7,9H,2,8H2,1H3