[(4-bromophenyl)-(2-methylsulfanyl-1,3-oxazol-5-yl)methyl] tetradecanoate

Systemtic Name: [(4-bromophenyl)-(2-methylsulfanyl-1,3-oxazol-5-yl)methyl] tetradecanoate Openeye Name: [(4-bromophenyl)-(2-methylsulfanyloxazol-5-yl)methyl] tetradecanoate CAS Name: tetradecanoic acid [(4-bromophenyl)-[2-(methylthio)-5-oxazolyl]methyl] ester IUPAC Name: [(4-bromophenyl)-(2-methylsulfanyl-1,3-oxazol-5-yl)methyl] tetradecanoate Traditional Name: myristic acid [(4-bromophenyl)-[2-(methylthio)oxazol-5-yl]methyl] ester Formula: C25H36BrNO3S MolecularWeight: 510.52724

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC(=O)OC(C1=CC=C(C=C1)Br)C2=CN=C(O2)SC

Isomeric SMILES

CCCCCCCCCCCCCC(=O)OC(C1=CC=C(C=C1)Br)C2=CN=C(O2)SC

InChI

InChI=1S/C25H36BrNO3S/c1-3-4-5-6-7-8-9-10-11-12-13-14-23(28)30-24(20-15-17-21(26)18-16-20)22-19-27-25(29-22)31-2/h15-19,24H,3-14H2,1-2H3