(2S)-2-azanyl-N-[4-(4-methylpiperazin-1-yl)phenyl]-4-methylsulfanyl-butanamide

Systemtic Name: (2S)-2-azanyl-N-[4-(4-methylpiperazin-1-yl)phenyl]-4-methylsulfanyl-butanamide Openeye Name: (2S)-2-amino-N-[4-(4-methylpiperazin-1-yl)phenyl]-4-methylsulfanyl-butanamide CAS Name: (2S)-2-amino-N-[4-(4-methyl-1-piperazinyl)phenyl]-4-(methylthio)butanamide IUPAC Name: (2S)-2-amino-N-[4-(4-methylpiperazin-1-yl)phenyl]-4-methylsulfanylbutanamide Traditional Name: (2S)-2-amino-N-[4-(4-methylpiperazino)phenyl]-4-(methylthio)butyramide Formula: C16H26N4OS MolecularWeight: 322.46884

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=CC=C(C=C2)NC(=O)C(CCSC)N

Isomeric SMILES

CN1CCN(CC1)C2=CC=C(C=C2)NC(=O)[C@H](CCSC)N

InChI

InChI=1S/C16H26N4OS/c1-19-8-10-20(11-9-19)14-5-3-13(4-6-14)18-16(21)15(17)7-12-22-2/h3-6,15H,7-12,17H2,1-2H3,(H,18,21)/t15-/m0/s1