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

Systemtic Name: 2-butyl-5-[4-(4-pentylcyclohexyl)-3-propoxy-phenyl]-1,3,4-thiadiazole Openeye Name: 2-butyl-5-[4-(4-pentylcyclohexyl)-3-propoxy-phenyl]-1,3,4-thiadiazole CAS Name: 2-butyl-5-[4-(4-pentylcyclohexyl)-3-propoxyphenyl]-1,3,4-thiadiazole IUPAC Name: 2-butyl-5-[4-(4-pentylcyclohexyl)-3-propoxyphenyl]-1,3,4-thiadiazole Traditional Name: 2-[4-(4-amylcyclohexyl)-3-propoxy-phenyl]-5-butyl-1,3,4-thiadiazole Formula: C26H40N2OS MolecularWeight: 428.6736

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CCC(CC1)C2=C(C=C(C=C2)C3=NN=C(S3)CCCC)OCCC

Isomeric SMILES

CCCCCC1CCC(CC1)C2=C(C=C(C=C2)C3=NN=C(S3)CCCC)OCCC

InChI

InChI=1S/C26H40N2OS/c1-4-7-9-10-20-12-14-21(15-13-20)23-17-16-22(19-24(23)29-18-6-3)26-28-27-25(30-26)11-8-5-2/h16-17,19-21H,4-15,18H2,1-3H3