5-phenyl-2-prop-2-enylsulfanyl-pyrimidine

Systemtic Name: 5-phenyl-2-prop-2-enylsulfanyl-pyrimidine Openeye Name: 2-allylsulfanyl-5-phenyl-pyrimidine CAS Name: 5-phenyl-2-(prop-2-enylthio)pyrimidine IUPAC Name: 5-phenyl-2-prop-2-enylsulfanylpyrimidine Traditional Name: 2-(allylthio)-5-phenyl-pyrimidine Formula: C13H12N2S MolecularWeight: 228.31278

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Descriptors Computed from Structure

Canonical SMILES:

C=CCSC1=NC=C(C=N1)C2=CC=CC=C2

Isomeric SMILES

C=CCSC1=NC=C(C=N1)C2=CC=CC=C2

InChI

InChI=1S/C13H12N2S/c1-2-8-16-13-14-9-12(10-15-13)11-6-4-3-5-7-11/h2-7,9-10H,1,8H2