2-heptyl-5-[4-[1-(4-pentylcyclohexyl)ethyl]phenyl]-1,3,4-thiadiazole

Systemtic Name: 2-heptyl-5-[4-[1-(4-pentylcyclohexyl)ethyl]phenyl]-1,3,4-thiadiazole Openeye Name: 2-heptyl-5-[4-[1-(4-pentylcyclohexyl)ethyl]phenyl]-1,3,4-thiadiazole CAS Name: 2-heptyl-5-[4-[1-(4-pentylcyclohexyl)ethyl]phenyl]-1,3,4-thiadiazole IUPAC Name: 2-heptyl-5-[4-[1-(4-pentylcyclohexyl)ethyl]phenyl]-1,3,4-thiadiazole Traditional Name: 2-[4-[1-(4-amylcyclohexyl)ethyl]phenyl]-5-heptyl-1,3,4-thiadiazole Formula: C28H44N2S MolecularWeight: 440.72736

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=NN=C(S1)C2=CC=C(C=C2)C(C)C3CCC(CC3)CCCCC

Isomeric SMILES

CCCCCCCC1=NN=C(S1)C2=CC=C(C=C2)C(C)C3CCC(CC3)CCCCC

InChI

InChI=1S/C28H44N2S/c1-4-6-8-9-11-13-27-29-30-28(31-27)26-20-18-25(19-21-26)22(3)24-16-14-23(15-17-24)12-10-7-5-2/h18-24H,4-17H2,1-3H3