AC1Q1MFO

3-(5-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-prop-2-enyl-1H-1,2,4-triazole-5-thione

Also Known As: 5-(5-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazole-3-thiol|4-allyl-5-(5-tert-butyl-4,5,6,7-tetrahydro-1-benzothien-2-yl)-4H-1,2,4-triazole-3-thiol|3-(5-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-prop-2-enyl-1H-1,2,4-triazole-5-thione|4-Allyl-5-(5-(tert-butyl)-4,5,6,7-tetrahydrobenzo[b]thiophen-2-yl)-4h-1,2,4-triazole-3-thiol|4-allyl-3-(5-tert-butyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-1H-1,2,4-triazole-5-thione

Molecular Formula	C17H23N3S2
Molecular Weight	333.13333 g/mol
LogP	5.00619
Topological Polar Surface Area	33.61 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	3
Rotatable Bonds	3
Exact Mass	333.13333
Monoisotopic Mass	333.13333
Heavy Atoms	22
Complexity	742.7776

Chemical Identifiers

CAS Number	790232-35-8
SMILES	CC(C)(C)C1CCC2=C(C1)C=C(S2)C3=NNC(=S)N3CC=C