4-chloranyl-2-methylsulfanyl-5-(3-phenylprop-1-ynyl)pyrimidine

Systemtic Name: 4-chloranyl-2-methylsulfanyl-5-(3-phenylprop-1-ynyl)pyrimidine Openeye Name: 4-chloro-2-methylsulfanyl-5-(3-phenylprop-1-ynyl)pyrimidine CAS Name: 4-chloro-2-(methylthio)-5-(3-phenylprop-1-ynyl)pyrimidine IUPAC Name: 4-chloro-2-methylsulfanyl-5-(3-phenylprop-1-ynyl)pyrimidine Traditional Name: 4-chloro-2-(methylthio)-5-(3-phenylprop-1-ynyl)pyrimidine Formula: C14H11ClN2S MolecularWeight: 274.76854

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=C(C(=N1)Cl)C#CCC2=CC=CC=C2

Isomeric SMILES

CSC1=NC=C(C(=N1)Cl)C#CCC2=CC=CC=C2

InChI

InChI=1S/C14H11ClN2S/c1-18-14-16-10-12(13(15)17-14)9-5-8-11-6-3-2-4-7-11/h2-4,6-7,10H,8H2,1H3