AC1NZNGM

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

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

Molecular Formula	C26H22ClN3O6S
Molecular Weight	539.0918 g/mol
LogP	6.41688
Topological Polar Surface Area	135.47 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	8
Rotatable Bonds	7
Exact Mass	539.0918
Monoisotopic Mass	539.0918
Heavy Atoms	37
Complexity	1465.242

Chemical Identifiers

CAS Number	489403-72-7
SMILES	CCOC(=O)C1=C(SC2=C1CCC(C2)C)NC(=O)/C(=C/C3=CC=C(O3)C4=CC(=C(C=C4)Cl)[N+](=O)[O-])/C#N