RefChem:448811

2-[[5-(4-tert-butylphenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]-N-(2,3-dimethylphenyl)acetamide

Also Known As: Oprea1_094866|Oprea1_819234|2-{[4-allyl-5-(4-tert-butylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,3-dimethylphenyl)acetamide|2-((4-Allyl-5-(4-(tert-butyl)phenyl)-4H-1,2,4-triazol-3-yl)thio)-N-(2,3-dimethylphenyl)acetamide|2-((4-Allyl-5-(4-tert-butylphenyl)-4H-1,2,4-triazol-3-YL)sulfanyl)-N-(2,3-dimethylphenyl)acetamide|2-[[5-(4-tert-butylphenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]-N-(2,3-dimethylphenyl)acetamide|2-{[5-(4-tert-butylphenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2,3-dimethylphenyl)acetamide|2-{5-[4-(tert-butyl)phenyl]-4-prop-2-enyl(1,2,4-triazol-3-ylthio)}-N-(2,3-dime thylphenyl)acetamide|644-877-3

Molecular Formula	C25H30N4OS
Molecular Weight	434.21402 g/mol
LogP	5.77624
Topological Polar Surface Area	59.81 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	4
Rotatable Bonds	7
Exact Mass	434.21402
Monoisotopic Mass	434.21402
Heavy Atoms	31
Complexity	1077.8917

Chemical Identifiers

CAS Number	538337-07-4
SMILES	CC1=C(C(=CC=C1)NC(=O)CSC2=NN=C(N2CC=C)C3=CC=C(C=C3)C(C)(C)C)C