1-[(2,5-diphenylpyrazol-3-yl)methyl]azepan-2-imine

Systemtic Name: 1-[(2,5-diphenylpyrazol-3-yl)methyl]azepan-2-imine Openeye Name: 1-[(2,5-diphenylpyrazol-3-yl)methyl]azepan-2-imine CAS Name: 1-[(2,5-diphenyl-3-pyrazolyl)methyl]-2-azepanimine IUPAC Name: 1-[(2,5-diphenylpyrazol-3-yl)methyl]azepan-2-imine Traditional Name: [1-[(2,5-diphenylpyrazol-3-yl)methyl]azepan-2-ylidene]amine Formula: C22H24N4 MolecularWeight: 344.45276

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=N)N(CC1)CC2=CC(=NN2C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1CCC(=N)N(CC1)CC2=CC(=NN2C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C22H24N4/c23-22-14-8-3-9-15-25(22)17-20-16-21(18-10-4-1-5-11-18)24-26(20)19-12-6-2-7-13-19/h1-2,4-7,10-13,16,23H,3,8-9,14-15,17H2