(2S)-N-(3-azanyl-4-fluoranyl-phenyl)-2-(4-methylpiperazin-1-yl)propanamide

Systemtic Name: (2S)-N-(3-azanyl-4-fluoranyl-phenyl)-2-(4-methylpiperazin-1-yl)propanamide Openeye Name: (2S)-N-(3-amino-4-fluoro-phenyl)-2-(4-methylpiperazin-1-yl)propanamide CAS Name: (2S)-N-(3-amino-4-fluorophenyl)-2-(4-methyl-1-piperazinyl)propanamide IUPAC Name: (2S)-N-(3-amino-4-fluorophenyl)-2-(4-methylpiperazin-1-yl)propanamide Traditional Name: (2S)-N-(3-amino-4-fluoro-phenyl)-2-(4-methylpiperazino)propionamide Formula: C14H21FN4O MolecularWeight: 280.341143

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=C(C=C1)F)N)N2CCN(CC2)C

Isomeric SMILES

C[C@@H](C(=O)NC1=CC(=C(C=C1)F)N)N2CCN(CC2)C

InChI

InChI=1S/C14H21FN4O/c1-10(19-7-5-18(2)6-8-19)14(20)17-11-3-4-12(15)13(16)9-11/h3-4,9-10H,5-8,16H2,1-2H3,(H,17,20)/t10-/m0/s1