2-[4-(2-methylbutylsulfanyl)phenyl]-5-nonyl-pyrimidine

Systemtic Name: 2-[4-(2-methylbutylsulfanyl)phenyl]-5-nonyl-pyrimidine Openeye Name: 2-[4-(2-methylbutylsulfanyl)phenyl]-5-nonyl-pyrimidine CAS Name: 2-[4-(2-methylbutylthio)phenyl]-5-nonylpyrimidine IUPAC Name: 2-[4-(2-methylbutylsulfanyl)phenyl]-5-nonylpyrimidine Traditional Name: 2-[4-(2-methylbutylthio)phenyl]-5-nonyl-pyrimidine Formula: C24H36N2S MolecularWeight: 384.62104

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)SCC(C)CC

Isomeric SMILES

CCCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)SCC(C)CC

InChI

InChI=1S/C24H36N2S/c1-4-6-7-8-9-10-11-12-21-17-25-24(26-18-21)22-13-15-23(16-14-22)27-19-20(3)5-2/h13-18,20H,4-12,19H2,1-3H3