N-(2-acetamidoethyl)-2-(4-azanyl-2-fluoranyl-phenyl)sulfanyl-ethanamide

Systemtic Name: N-(2-acetamidoethyl)-2-(4-azanyl-2-fluoranyl-phenyl)sulfanyl-ethanamide Openeye Name: N-(2-acetamidoethyl)-2-(4-amino-2-fluoro-phenyl)sulfanyl-acetamide CAS Name: N-(2-acetamidoethyl)-2-[(4-amino-2-fluorophenyl)thio]acetamide IUPAC Name: N-(2-acetamidoethyl)-2-(4-amino-2-fluorophenyl)sulfanylacetamide Traditional Name: N-(2-acetamidoethyl)-2-[(4-amino-2-fluoro-phenyl)thio]acetamide Formula: C12H16FN3O2S MolecularWeight: 285.337743

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCNC(=O)CSC1=C(C=C(C=C1)N)F

Isomeric SMILES

CC(=O)NCCNC(=O)CSC1=C(C=C(C=C1)N)F

InChI

InChI=1S/C12H16FN3O2S/c1-8(17)15-4-5-16-12(18)7-19-11-3-2-9(14)6-10(11)13/h2-3,6H,4-5,7,14H2,1H3,(H,15,17)(H,16,18)