5-heptyl-2-(4-heptylsulfanylphenyl)pyrimidine

Systemtic Name: 5-heptyl-2-(4-heptylsulfanylphenyl)pyrimidine Openeye Name: 5-heptyl-2-(4-heptylsulfanylphenyl)pyrimidine CAS Name: 5-heptyl-2-[4-(heptylthio)phenyl]pyrimidine IUPAC Name: 5-heptyl-2-(4-heptylsulfanylphenyl)pyrimidine Traditional Name: 5-heptyl-2-[4-(heptylthio)phenyl]pyrimidine Formula: C24H36N2S MolecularWeight: 384.62104

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)SCCCCCCC

Isomeric SMILES

CCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)SCCCCCCC

InChI

InChI=1S/C24H36N2S/c1-3-5-7-9-11-13-21-19-25-24(26-20-21)22-14-16-23(17-15-22)27-18-12-10-8-6-4-2/h14-17,19-20H,3-13,18H2,1-2H3