N3-(2,2-dimethylbutyl)-2,5-dimethyl-N4-(phenylmethyl)pyrazole-3,4-diamine

Systemtic Name: N3-(2,2-dimethylbutyl)-2,5-dimethyl-N4-(phenylmethyl)pyrazole-3,4-diamine Openeye Name: N4-benzyl-N3-(2,2-dimethylbutyl)-2,5-dimethyl-pyrazole-3,4-diamine CAS Name: N3-(2,2-dimethylbutyl)-2,5-dimethyl-N4-(phenylmethyl)pyrazole-3,4-diamine IUPAC Name: 4-N-benzyl-3-N-(2,2-dimethylbutyl)-2,5-dimethylpyrazole-3,4-diamine Traditional Name: benzyl-[5-(2,2-dimethylbutylamino)-1,3-dimethyl-pyrazol-4-yl]amine Formula: C18H28N4 MolecularWeight: 300.44172

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)CNC1=C(C(=NN1C)C)NCC2=CC=CC=C2

Isomeric SMILES

CCC(C)(C)CNC1=C(C(=NN1C)C)NCC2=CC=CC=C2

InChI

InChI=1S/C18H28N4/c1-6-18(3,4)13-20-17-16(14(2)21-22(17)5)19-12-15-10-8-7-9-11-15/h7-11,19-20H,6,12-13H2,1-5H3