AC1M14CE

butyl 4-[5-[(E)-3-[[5-[(2-chlorophenyl)methyl]-1,3-thiazol-2-yl]amino]-2-cyano-3-oxoprop-1-enyl]furan-2-yl]benzoate

Also Known As: butyl 4-[5-[(E)-3-[[5-[(2-chlorophenyl)methyl]-1,3-thiazol-2-yl]amino]-2-cyano-3-oxoprop-1-enyl]furan-2-yl]benzoate|butyl 4-{5-[(1E)-2-(N-{5-[(2-chlorophenyl)methyl](1,3-thiazol-2-yl)}carbamoyl) -2-cyanovinyl]-2-furyl}benzoate|Butyl 4-{5-[(1E)-2-(N-{5-[(2-chlorophenyl)methyl](1,3-thiazol-2-yl)}carbamoyl)-2-cyanovinyl]-2-furyl}benzoate|butyl 4-{5-[2-({5-[(2-chlorophenyl)methyl]-1,3-thiazol-2-yl}carbamoyl)-2-cyanoeth-1-en-1-yl]furan-2-yl}benzoate

Molecular Formula	C29H24ClN3O4S
Molecular Weight	545.1176 g/mol
LogP	7.14988
Topological Polar Surface Area	105.22 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	7
Rotatable Bonds	10
Exact Mass	545.1176
Monoisotopic Mass	545.1176
Heavy Atoms	38
Complexity	1498.5107

Chemical Identifiers

CAS Number	501108-75-4
SMILES	CCCCOC(=O)C1=CC=C(C=C1)C2=CC=C(O2)/C=C(\C#N)/C(=O)NC3=NC=C(S3)CC4=CC=CC=C4Cl