2-(4-butoxyphenyl)-5-(4-nonoxyphenyl)-1,3,4-thiadiazole

Systemtic Name: 2-(4-butoxyphenyl)-5-(4-nonoxyphenyl)-1,3,4-thiadiazole Openeye Name: 2-(4-butoxyphenyl)-5-(4-nonoxyphenyl)-1,3,4-thiadiazole CAS Name: 2-(4-butoxyphenyl)-5-(4-nonoxyphenyl)-1,3,4-thiadiazole IUPAC Name: 2-(4-butoxyphenyl)-5-(4-nonoxyphenyl)-1,3,4-thiadiazole Traditional Name: 2-(4-butoxyphenyl)-5-(4-nonoxyphenyl)-1,3,4-thiadiazole Formula: C27H36N2O2S MolecularWeight: 452.65194

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCOC1=CC=C(C=C1)C2=NN=C(S2)C3=CC=C(C=C3)OCCCC

Isomeric SMILES

CCCCCCCCCOC1=CC=C(C=C1)C2=NN=C(S2)C3=CC=C(C=C3)OCCCC

InChI

InChI=1S/C27H36N2O2S/c1-3-5-7-8-9-10-11-21-31-25-18-14-23(15-19-25)27-29-28-26(32-27)22-12-16-24(17-13-22)30-20-6-4-2/h12-19H,3-11,20-21H2,1-2H3