5-tert-butyl-2-(6-dodecylsulfanylpyridin-2-yl)pyrazol-3-amine

Systemtic Name: 5-tert-butyl-2-(6-dodecylsulfanylpyridin-2-yl)pyrazol-3-amine Openeye Name: 5-tert-butyl-2-(6-dodecylsulfanyl-2-pyridyl)pyrazol-3-amine CAS Name: 5-tert-butyl-2-[6-(dodecylthio)-2-pyridinyl]-3-pyrazolamine IUPAC Name: 5-tert-butyl-2-(6-dodecylsulfanylpyridin-2-yl)pyrazol-3-amine Traditional Name: [5-tert-butyl-2-[6-(laurylthio)-2-pyridyl]pyrazol-3-yl]amine Formula: C24H40N4S MolecularWeight: 416.6662

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCSC1=CC=CC(=N1)N2C(=CC(=N2)C(C)(C)C)N

Isomeric SMILES

CCCCCCCCCCCCSC1=CC=CC(=N1)N2C(=CC(=N2)C(C)(C)C)N

InChI

InChI=1S/C24H40N4S/c1-5-6-7-8-9-10-11-12-13-14-18-29-23-17-15-16-22(26-23)28-21(25)19-20(27-28)24(2,3)4/h15-17,19H,5-14,18,25H2,1-4H3