3-[(4-aminophenyl)methylamino]-5-azanyl-1H-pyrazole-4-carbonitrile

Systemtic Name: 3-[(4-aminophenyl)methylamino]-5-azanyl-1H-pyrazole-4-carbonitrile Openeye Name: 5-amino-3-[(4-aminophenyl)methylamino]-1H-pyrazole-4-carbonitrile CAS Name: 5-amino-3-[(4-aminophenyl)methylamino]-1H-pyrazole-4-carbonitrile IUPAC Name: 5-amino-3-[(4-aminophenyl)methylamino]-1H-pyrazole-4-carbonitrile Traditional Name: 5-amino-3-[(4-aminobenzyl)amino]-1H-pyrazole-4-carbonitrile Formula: C11H12N6 MolecularWeight: 228.25318

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC2=NNC(=C2C#N)N)N

Isomeric SMILES

C1=CC(=CC=C1CNC2=NNC(=C2C#N)N)N

InChI

InChI=1S/C11H12N6/c12-5-9-10(14)16-17-11(9)15-6-7-1-3-8(13)4-2-7/h1-4H,6,13H2,(H4,14,15,16,17)