1-[(3R,4S)-2,5-diphenyl-3-pyridin-3-yl-3,4-dihydropyrazol-4-yl]benzotriazole

Systemtic Name: 1-[(3R,4S)-2,5-diphenyl-3-pyridin-3-yl-3,4-dihydropyrazol-4-yl]benzotriazole Openeye Name: 1-[(3R,4S)-2,5-diphenyl-3-(3-pyridyl)-3,4-dihydropyrazol-4-yl]benzotriazole CAS Name: 1-[(3R,4S)-2,5-diphenyl-3-(3-pyridinyl)-3,4-dihydropyrazol-4-yl]benzotriazole IUPAC Name: 1-[(3R,4S)-2,5-diphenyl-3-pyridin-3-yl-3,4-dihydropyrazol-4-yl]benzotriazole Traditional Name: 1-[(4S,5R)-1,3-diphenyl-5-(3-pyridyl)-2-pyrazolin-4-yl]benzotriazole Formula: C26H20N6 MolecularWeight: 416.4772

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN(C(C2N3C4=CC=CC=C4N=N3)C5=CN=CC=C5)C6=CC=CC=C6

Isomeric SMILES

C1=CC=C(C=C1)C2=NN([C@@H]([C@@H]2N3C4=CC=CC=C4N=N3)C5=CN=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C26H20N6/c1-3-10-19(11-4-1)24-26(32-23-16-8-7-15-22(23)28-30-32)25(20-12-9-17-27-18-20)31(29-24)21-13-5-2-6-14-21/h1-18,25-26H/t25-,26-/m1/s1