1-[3-(4-tert-butylphenyl)-3-pentylsulfanyl-propyl]imidazole

Systemtic Name: 1-[3-(4-tert-butylphenyl)-3-pentylsulfanyl-propyl]imidazole Openeye Name: 1-[3-(4-tert-butylphenyl)-3-pentylsulfanyl-propyl]imidazole CAS Name: 1-[3-(4-tert-butylphenyl)-3-(pentylthio)propyl]imidazole IUPAC Name: 1-[3-(4-tert-butylphenyl)-3-pentylsulfanylpropyl]imidazole Traditional Name: 1-[3-(amylthio)-3-(4-tert-butylphenyl)propyl]imidazole Formula: C21H32N2S MolecularWeight: 344.55718

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCSC(CCN1C=CN=C1)C2=CC=C(C=C2)C(C)(C)C

Isomeric SMILES

CCCCCSC(CCN1C=CN=C1)C2=CC=C(C=C2)C(C)(C)C

InChI

InChI=1S/C21H32N2S/c1-5-6-7-16-24-20(12-14-23-15-13-22-17-23)18-8-10-19(11-9-18)21(2,3)4/h8-11,13,15,17,20H,5-7,12,14,16H2,1-4H3