5-ethyl-N4,2-dimethyl-N4-phenyl-pyrazole-3,4-diamine

Systemtic Name: 5-ethyl-N4,2-dimethyl-N4-phenyl-pyrazole-3,4-diamine Openeye Name: 5-ethyl-N4,2-dimethyl-N4-phenyl-pyrazole-3,4-diamine CAS Name: 5-ethyl-N4,2-dimethyl-N4-phenylpyrazole-3,4-diamine IUPAC Name: 5-ethyl-4-N,2-dimethyl-4-N-phenylpyrazole-3,4-diamine Traditional Name: (5-amino-3-ethyl-1-methyl-pyrazol-4-yl)-methyl-phenyl-amine Formula: C13H18N4 MolecularWeight: 230.30882

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN(C(=C1N(C)C2=CC=CC=C2)N)C

Isomeric SMILES

CCC1=NN(C(=C1N(C)C2=CC=CC=C2)N)C

InChI

InChI=1S/C13H18N4/c1-4-11-12(13(14)17(3)15-11)16(2)10-8-6-5-7-9-10/h5-9H,4,14H2,1-3H3