AC1LUTJI

ethyl 2-[[(E)-3-[5-[2-chloro-5-(trifluoromethyl)phenyl]furan-2-yl]-2-cyanoprop-2-enoyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Also Known As: ethyl 2-[[(E)-3-[5-[2-chloro-5-(trifluoromethyl)phenyl]furan-2-yl]-2-cyanoprop-2-enoyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate|(E)-ethyl 2-(3-(5-(2-chloro-5-(trifluoromethyl)phenyl)furan-2-yl)-2-cyanoacrylamido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate|ethyl 2-((2E)-3-{5-[2-chloro-5-(trifluoromethyl)phenyl](2-furyl)}-2-cyanoprop- 2-enoylamino)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate

Molecular Formula	C26H20ClF3N2O4S
Molecular Weight	548.0784 g/mol
LogP	7.28148
Topological Polar Surface Area	92.33 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	6
Rotatable Bonds	6
Exact Mass	548.0784
Monoisotopic Mass	548.0784
Heavy Atoms	37
Complexity	1432.3986

Chemical Identifiers

CAS Number	469877-01-8
SMILES	CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)/C(=C/C3=CC=C(O3)C4=C(C=CC(=C4)C(F)(F)F)Cl)/C#N