ethyl 2-phenyl-2-(2-pyrimidin-4-ylethylsulfanyl)ethanoate

Systemtic Name: ethyl 2-phenyl-2-(2-pyrimidin-4-ylethylsulfanyl)ethanoate Openeye Name: ethyl 2-phenyl-2-(2-pyrimidin-4-ylethylsulfanyl)acetate CAS Name: 2-phenyl-2-[2-(4-pyrimidinyl)ethylthio]acetic acid ethyl ester IUPAC Name: ethyl 2-phenyl-2-(2-pyrimidin-4-ylethylsulfanyl)acetate Traditional Name: 2-phenyl-2-[2-(4-pyrimidyl)ethylthio]acetic acid ethyl ester Formula: C16H18N2O2S MolecularWeight: 302.39132

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1=CC=CC=C1)SCCC2=NC=NC=C2

Isomeric SMILES

CCOC(=O)C(C1=CC=CC=C1)SCCC2=NC=NC=C2

InChI

InChI=1S/C16H18N2O2S/c1-2-20-16(19)15(13-6-4-3-5-7-13)21-11-9-14-8-10-17-12-18-14/h3-8,10,12,15H,2,9,11H2,1H3