2-[4-(4-chloranylphenoxy)but-2-ynylsulfanyl]pyrimidine

Systemtic Name: 2-[4-(4-chloranylphenoxy)but-2-ynylsulfanyl]pyrimidine Openeye Name: 2-[4-(4-chlorophenoxy)but-2-ynylsulfanyl]pyrimidine CAS Name: 2-[4-(4-chlorophenoxy)but-2-ynylthio]pyrimidine IUPAC Name: 2-[4-(4-chlorophenoxy)but-2-ynylsulfanyl]pyrimidine Traditional Name: 2-[4-(4-chlorophenoxy)but-2-ynylthio]pyrimidine Formula: C14H11ClN2OS MolecularWeight: 290.76794

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(N=C1)SCC#CCOC2=CC=C(C=C2)Cl

Isomeric SMILES

C1=CN=C(N=C1)SCC#CCOC2=CC=C(C=C2)Cl

InChI

InChI=1S/C14H11ClN2OS/c15-12-4-6-13(7-5-12)18-10-1-2-11-19-14-16-8-3-9-17-14/h3-9H,10-11H2