2-(4-pentoxyphenyl)-5-(4-pentylcyclohexyl)-3-propoxy-2H-1,3,4-thiadiazole

Systemtic Name: 2-(4-pentoxyphenyl)-5-(4-pentylcyclohexyl)-3-propoxy-2H-1,3,4-thiadiazole Openeye Name: 2-(4-pentoxyphenyl)-5-(4-pentylcyclohexyl)-3-propoxy-2H-1,3,4-thiadiazole CAS Name: 2-(4-pentoxyphenyl)-5-(4-pentylcyclohexyl)-3-propoxy-2H-1,3,4-thiadiazole IUPAC Name: 2-(4-pentoxyphenyl)-5-(4-pentylcyclohexyl)-3-propoxy-2H-1,3,4-thiadiazole Traditional Name: 2-(4-amoxyphenyl)-5-(4-amylcyclohexyl)-3-propoxy-2H-1,3,4-thiadiazole Formula: C27H44N2O2S MolecularWeight: 460.71546

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CCC(CC1)C2=NN(C(S2)C3=CC=C(C=C3)OCCCCC)OCCC

Isomeric SMILES

CCCCCC1CCC(CC1)C2=NN(C(S2)C3=CC=C(C=C3)OCCCCC)OCCC

InChI

InChI=1S/C27H44N2O2S/c1-4-7-9-11-22-12-14-23(15-13-22)26-28-29(31-20-6-3)27(32-26)24-16-18-25(19-17-24)30-21-10-8-5-2/h16-19,22-23,27H,4-15,20-21H2,1-3H3