2-[2-(2-cyclohexyl-4-pentan-2-yl-phenyl)ethyl]-5-pentyl-1,3,4-thiadiazole

Systemtic Name: 2-[2-(2-cyclohexyl-4-pentan-2-yl-phenyl)ethyl]-5-pentyl-1,3,4-thiadiazole Openeye Name: 2-[2-[2-cyclohexyl-4-(1-methylbutyl)phenyl]ethyl]-5-pentyl-1,3,4-thiadiazole CAS Name: 2-[2-(2-cyclohexyl-4-pentan-2-ylphenyl)ethyl]-5-pentyl-1,3,4-thiadiazole IUPAC Name: 2-[2-(2-cyclohexyl-4-pentan-2-ylphenyl)ethyl]-5-pentyl-1,3,4-thiadiazole Traditional Name: 2-amyl-5-[2-[2-cyclohexyl-4-(1-methylbutyl)phenyl]ethyl]-1,3,4-thiadiazole Formula: C26H40N2S MolecularWeight: 412.6742

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=NN=C(S1)CCC2=C(C=C(C=C2)C(C)CCC)C3CCCCC3

Isomeric SMILES

CCCCCC1=NN=C(S1)CCC2=C(C=C(C=C2)C(C)CCC)C3CCCCC3

InChI

InChI=1S/C26H40N2S/c1-4-6-8-14-25-27-28-26(29-25)18-17-22-15-16-23(20(3)11-5-2)19-24(22)21-12-9-7-10-13-21/h15-16,19-21H,4-14,17-18H2,1-3H3