tert-butyl N-[2-fluoranyl-5-(3-thiophen-3-ylpropanoylamino)phenyl]carbamate

Systemtic Name: tert-butyl N-[2-fluoranyl-5-(3-thiophen-3-ylpropanoylamino)phenyl]carbamate Openeye Name: tert-butyl N-[2-fluoro-5-[3-(3-thienyl)propanoylamino]phenyl]carbamate CAS Name: N-[2-fluoro-5-[[1-oxo-3-(3-thiophenyl)propyl]amino]phenyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[2-fluoro-5-(3-thiophen-3-ylpropanoylamino)phenyl]carbamate Traditional Name: N-[2-fluoro-5-[3-(3-thienyl)propanoylamino]phenyl]carbamic acid tert-butyl ester Formula: C18H21FN2O3S MolecularWeight: 364.434343

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=C(C=CC(=C1)NC(=O)CCC2=CSC=C2)F

Isomeric SMILES

CC(C)(C)OC(=O)NC1=C(C=CC(=C1)NC(=O)CCC2=CSC=C2)F

InChI

InChI=1S/C18H21FN2O3S/c1-18(2,3)24-17(23)21-15-10-13(5-6-14(15)19)20-16(22)7-4-12-8-9-25-11-12/h5-6,8-11H,4,7H2,1-3H3,(H,20,22)(H,21,23)