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

Systemtic Name: (3-pyrazol-1-ylphenyl)methyl-[(4S)-1-pyridin-2-yl-4,5,6,7-tetrahydroindazol-4-yl]azanium Openeye Name: (3-pyrazol-1-ylphenyl)methyl-[(4S)-1-(2-pyridyl)-4,5,6,7-tetrahydroindazol-4-yl]ammonium CAS Name: [3-(1-pyrazolyl)phenyl]methyl-[(4S)-1-(2-pyridinyl)-4,5,6,7-tetrahydroindazol-4-yl]ammonium IUPAC Name: (3-pyrazol-1-ylphenyl)methyl-[(4S)-1-pyridin-2-yl-4,5,6,7-tetrahydroindazol-4-yl]azanium Traditional Name: (3-pyrazol-1-ylbenzyl)-[(4S)-1-(2-pyridyl)-4,5,6,7-tetrahydroindazol-4-yl]ammonium Formula: C22H23N6+ MolecularWeight: 371.45822

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C2=C(C1)N(N=C2)C3=CC=CC=N3)[NH2+]CC4=CC(=CC=C4)N5C=CC=N5

Isomeric SMILES

C1C[C@@H](C2=C(C1)N(N=C2)C3=CC=CC=N3)[NH2+]CC4=CC(=CC=C4)N5C=CC=N5

InChI

InChI=1S/C22H22N6/c1-2-11-23-22(10-1)28-21-9-4-8-20(19(21)16-26-28)24-15-17-6-3-7-18(14-17)27-13-5-12-25-27/h1-3,5-7,10-14,16,20,24H,4,8-9,15H2/p+1/t20-/m0/s1