(2S)-2-azanyl-3-[4-(3-azanyl-1H-1,2,4-triazol-5-yl)phenyl]propanal

Systemtic Name: (2S)-2-azanyl-3-[4-(3-azanyl-1H-1,2,4-triazol-5-yl)phenyl]propanal Openeye Name: (2S)-2-amino-3-[4-(3-amino-1H-1,2,4-triazol-5-yl)phenyl]propanal CAS Name: (2S)-2-amino-3-[4-(3-amino-1H-1,2,4-triazol-5-yl)phenyl]propanal IUPAC Name: (2S)-2-amino-3-[4-(3-amino-1H-1,2,4-triazol-5-yl)phenyl]propanal Traditional Name: (2S)-2-amino-3-[4-(3-amino-1H-1,2,4-triazol-5-yl)phenyl]propionaldehyde Formula: C11H13N5O MolecularWeight: 231.25382

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC(C=O)N)C2=NC(=NN2)N

Isomeric SMILES

C1=CC(=CC=C1C[C@@H](C=O)N)C2=NC(=NN2)N

InChI

InChI=1S/C11H13N5O/c12-9(6-17)5-7-1-3-8(4-2-7)10-14-11(13)16-15-10/h1-4,6,9H,5,12H2,(H3,13,14,15,16)/t9-/m0/s1