2-(4-chlorophenyl)-5-[4-(4-pentylphenyl)cyclohexyl]-1,3,4-thiadiazole

Systemtic Name: 2-(4-chlorophenyl)-5-[4-(4-pentylphenyl)cyclohexyl]-1,3,4-thiadiazole Openeye Name: 2-(4-chlorophenyl)-5-[4-(4-pentylphenyl)cyclohexyl]-1,3,4-thiadiazole CAS Name: 2-(4-chlorophenyl)-5-[4-(4-pentylphenyl)cyclohexyl]-1,3,4-thiadiazole IUPAC Name: 2-(4-chlorophenyl)-5-[4-(4-pentylphenyl)cyclohexyl]-1,3,4-thiadiazole Traditional Name: 2-[4-(4-amylphenyl)cyclohexyl]-5-(4-chlorophenyl)-1,3,4-thiadiazole Formula: C25H29ClN2S MolecularWeight: 425.02916

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C2CCC(CC2)C3=NN=C(S3)C4=CC=C(C=C4)Cl

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C2CCC(CC2)C3=NN=C(S3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C25H29ClN2S/c1-2-3-4-5-18-6-8-19(9-7-18)20-10-12-21(13-11-20)24-27-28-25(29-24)22-14-16-23(26)17-15-22/h6-9,14-17,20-21H,2-5,10-13H2,1H3