(1,3-diphenylpyrazol-4-yl)methyl-[(4S)-1-pyridin-2-yl-4,5,6,7-tetrahydroindazol-4-yl]azanium

Systemtic Name: (1,3-diphenylpyrazol-4-yl)methyl-[(4S)-1-pyridin-2-yl-4,5,6,7-tetrahydroindazol-4-yl]azanium Openeye Name: (1,3-diphenylpyrazol-4-yl)methyl-[(4S)-1-(2-pyridyl)-4,5,6,7-tetrahydroindazol-4-yl]ammonium CAS Name: (1,3-diphenyl-4-pyrazolyl)methyl-[(4S)-1-(2-pyridinyl)-4,5,6,7-tetrahydroindazol-4-yl]ammonium IUPAC Name: (1,3-diphenylpyrazol-4-yl)methyl-[(4S)-1-pyridin-2-yl-4,5,6,7-tetrahydroindazol-4-yl]azanium Traditional Name: (1,3-diphenylpyrazol-4-yl)methyl-[(4S)-1-(2-pyridyl)-4,5,6,7-tetrahydroindazol-4-yl]ammonium Formula: C28H27N6+ MolecularWeight: 447.55418

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C2=C(C1)N(N=C2)C3=CC=CC=N3)[NH2+]CC4=CN(N=C4C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

C1C[C@@H](C2=C(C1)N(N=C2)C3=CC=CC=N3)[NH2+]CC4=CN(N=C4C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C28H26N6/c1-3-10-21(11-4-1)28-22(20-33(32-28)23-12-5-2-6-13-23)18-30-25-14-9-15-26-24(25)19-31-34(26)27-16-7-8-17-29-27/h1-8,10-13,16-17,19-20,25,30H,9,14-15,18H2/p+1/t25-/m0/s1