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5-(4-decoxyphenyl)-2-decylsulfanyl-pyrimidine

Systemtic Name:	5-(4-decoxyphenyl)-2-decylsulfanyl-pyrimidine
Openeye Name:	5-(4-decoxyphenyl)-2-decylsulfanyl-pyrimidine
CAS Name:	5-(4-decoxyphenyl)-2-(decylthio)pyrimidine
IUPAC Name:	5-(4-decoxyphenyl)-2-decylsulfanylpyrimidine
Traditional Name:	5-(4-decoxyphenyl)-2-(decylthio)pyrimidine
Formula:	C₃₀H₄₈N₂OS
MolecularWeight:	484.77992

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=CC=C(C=C1)C2=CN=C(N=C2)SCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCOC1=CC=C(C=C1)C2=CN=C(N=C2)SCCCCCCCCCC

InChI

InChI=1S/C30H48N2OS/c1-3-5-7-9-11-13-15-17-23-33-29-21-19-27(20-22-29)28-25-31-30(32-26-28)34-24-18-16-14-12-10-8-6-4-2/h19-22,25-26H,3-18,23-24H2,1-2H3

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ethyl 3-dodecylsulfanylpropanoate