2-(4-methoxy-2-pentadecoxy-phenyl)-5-methylsulfanyl-1,3,4-thiadiazole

Systemtic Name: 2-(4-methoxy-2-pentadecoxy-phenyl)-5-methylsulfanyl-1,3,4-thiadiazole Openeye Name: 2-(4-methoxy-2-pentadecoxy-phenyl)-5-methylsulfanyl-1,3,4-thiadiazole CAS Name: 2-(4-methoxy-2-pentadecoxyphenyl)-5-(methylthio)-1,3,4-thiadiazole IUPAC Name: 2-(4-methoxy-2-pentadecoxyphenyl)-5-methylsulfanyl-1,3,4-thiadiazole Traditional Name: 2-(4-methoxy-2-pentadecoxy-phenyl)-5-(methylthio)-1,3,4-thiadiazole Formula: C25H40N2O2S2 MolecularWeight: 464.7273

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCOC1=C(C=CC(=C1)OC)C2=NN=C(S2)SC

Isomeric SMILES

CCCCCCCCCCCCCCCOC1=C(C=CC(=C1)OC)C2=NN=C(S2)SC

InChI

InChI=1S/C25H40N2O2S2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-19-29-23-20-21(28-2)17-18-22(23)24-26-27-25(30-3)31-24/h17-18,20H,4-16,19H2,1-3H3