ethyl 2-[3-chloranyl-2-oxidanylidene-6-(phenylsulfanylmethyl)pyrazin-1-yl]ethanoate

Systemtic Name: ethyl 2-[3-chloranyl-2-oxidanylidene-6-(phenylsulfanylmethyl)pyrazin-1-yl]ethanoate Openeye Name: ethyl 2-[3-chloro-2-oxo-6-(phenylsulfanylmethyl)pyrazin-1-yl]acetate CAS Name: 2-[3-chloro-2-oxo-6-[(phenylthio)methyl]-1-pyrazinyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[3-chloro-2-oxo-6-(phenylsulfanylmethyl)pyrazin-1-yl]acetate Traditional Name: 2-[3-chloro-2-keto-6-[(phenylthio)methyl]pyrazin-1-yl]acetic acid ethyl ester Formula: C15H15ClN2O3S MolecularWeight: 338.8092

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C(=CN=C(C1=O)Cl)CSC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)CN1C(=CN=C(C1=O)Cl)CSC2=CC=CC=C2

InChI

InChI=1S/C15H15ClN2O3S/c1-2-21-13(19)9-18-11(8-17-14(16)15(18)20)10-22-12-6-4-3-5-7-12/h3-8H,2,9-10H2,1H3