2-(4-pyrimidin-2-ylphenyl)ethanethiol

Systemtic Name: 2-(4-pyrimidin-2-ylphenyl)ethanethiol Openeye Name: 2-(4-pyrimidin-2-ylphenyl)ethanethiol CAS Name: 2-[4-(2-pyrimidinyl)phenyl]ethanethiol IUPAC Name: 2-(4-pyrimidin-2-ylphenyl)ethanethiol Traditional Name: 2-[4-(2-pyrimidyl)phenyl]ethanethiol Formula: C12H12N2S MolecularWeight: 216.30208

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(N=C1)C2=CC=C(C=C2)CCS

Isomeric SMILES

C1=CN=C(N=C1)C2=CC=C(C=C2)CCS

InChI

InChI=1S/C12H12N2S/c15-9-6-10-2-4-11(5-3-10)12-13-7-1-8-14-12/h1-5,7-8,15H,6,9H2