3-[4-(4-tert-butylphenyl)-5-(ethyldisulfanyl)-1,2,4-triazol-3-yl]piperidine

Systemtic Name: 3-[4-(4-tert-butylphenyl)-5-(ethyldisulfanyl)-1,2,4-triazol-3-yl]piperidine Openeye Name: 3-[4-(4-tert-butylphenyl)-5-(ethyldisulfanyl)-1,2,4-triazol-3-yl]piperidine CAS Name: 3-[4-(4-tert-butylphenyl)-5-(ethyldisulfanyl)-1,2,4-triazol-3-yl]piperidine IUPAC Name: 3-[4-(4-tert-butylphenyl)-5-(ethyldisulfanyl)-1,2,4-triazol-3-yl]piperidine Traditional Name: 3-[4-(4-tert-butylphenyl)-5-(ethyldisulfanyl)-1,2,4-triazol-3-yl]piperidine Formula: C19H28N4S2 MolecularWeight: 376.58242

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Descriptors Computed from Structure

Canonical SMILES:

CCSSC1=NN=C(N1C2=CC=C(C=C2)C(C)(C)C)C3CCCNC3

Isomeric SMILES

CCSSC1=NN=C(N1C2=CC=C(C=C2)C(C)(C)C)C3CCCNC3

InChI

InChI=1S/C19H28N4S2/c1-5-24-25-18-22-21-17(14-7-6-12-20-13-14)23(18)16-10-8-15(9-11-16)19(2,3)4/h8-11,14,20H,5-7,12-13H2,1-4H3