(2S)-N-(4-aminophenyl)-2-[bis(cyanomethyl)amino]propanamide

Systemtic Name: (2S)-N-(4-aminophenyl)-2-[bis(cyanomethyl)amino]propanamide Openeye Name: (2S)-N-(4-aminophenyl)-2-[bis(cyanomethyl)amino]propanamide CAS Name: (2S)-N-(4-aminophenyl)-2-[bis(cyanomethyl)amino]propanamide IUPAC Name: (2S)-N-(4-aminophenyl)-2-[bis(cyanomethyl)amino]propanamide Traditional Name: (2S)-N-(4-aminophenyl)-2-[bis(cyanomethyl)amino]propionamide Formula: C13H15N5O MolecularWeight: 257.2911

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)N)N(CC#N)CC#N

Isomeric SMILES

C[C@@H](C(=O)NC1=CC=C(C=C1)N)N(CC#N)CC#N

InChI

InChI=1S/C13H15N5O/c1-10(18(8-6-14)9-7-15)13(19)17-12-4-2-11(16)3-5-12/h2-5,10H,8-9,16H2,1H3,(H,17,19)/t10-/m0/s1