2-[1-(4-chloranyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)ethoxy]ethanoate

Systemtic Name: 2-[1-(4-chloranyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)ethoxy]ethanoate Openeye Name: 2-[1-(4-chloro-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-2-yl)ethoxy]acetate CAS Name: 2-[1-(4-chloro-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)ethoxy]acetate IUPAC Name: 2-[1-(4-chloro-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-2-yl)ethoxy]acetate Traditional Name: 2-[1-(4-chloro-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-2-yl)ethoxy]acetate Formula: C14H14ClN2O3S- MolecularWeight: 325.79056

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC2=C(C3=C(S2)CCCC3)C(=N1)Cl)OCC(=O)[O-]

Isomeric SMILES

CC(C1=NC2=C(C3=C(S2)CCCC3)C(=N1)Cl)OCC(=O)[O-]

InChI

InChI=1S/C14H15ClN2O3S/c1-7(20-6-10(18)19)13-16-12(15)11-8-4-2-3-5-9(8)21-14(11)17-13/h7H,2-6H2,1H3,(H,18,19)/p-1