2-(4-butoxyphenyl)-5-[3-(4-pentylcyclohexyl)propoxy]-1,3,4-thiadiazole

Systemtic Name: 2-(4-butoxyphenyl)-5-[3-(4-pentylcyclohexyl)propoxy]-1,3,4-thiadiazole Openeye Name: 2-(4-butoxyphenyl)-5-[3-(4-pentylcyclohexyl)propoxy]-1,3,4-thiadiazole CAS Name: 2-(4-butoxyphenyl)-5-[3-(4-pentylcyclohexyl)propoxy]-1,3,4-thiadiazole IUPAC Name: 2-(4-butoxyphenyl)-5-[3-(4-pentylcyclohexyl)propoxy]-1,3,4-thiadiazole Traditional Name: 2-[3-(4-amylcyclohexyl)propoxy]-5-(4-butoxyphenyl)-1,3,4-thiadiazole Formula: C26H40N2O2S MolecularWeight: 444.673

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CCC(CC1)CCCOC2=NN=C(S2)C3=CC=C(C=C3)OCCCC

Isomeric SMILES

CCCCCC1CCC(CC1)CCCOC2=NN=C(S2)C3=CC=C(C=C3)OCCCC

InChI

InChI=1S/C26H40N2O2S/c1-3-5-7-9-21-11-13-22(14-12-21)10-8-20-30-26-28-27-25(31-26)23-15-17-24(18-16-23)29-19-6-4-2/h15-18,21-22H,3-14,19-20H2,1-2H3