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

Systemtic Name: 1-[(3S,4S)-2-methyl-3,5-diphenyl-3,4-dihydropyrazol-4-yl]benzotriazole Openeye Name: 1-[(3S,4S)-2-methyl-3,5-diphenyl-3,4-dihydropyrazol-4-yl]benzotriazole CAS Name: 1-[(3S,4S)-2-methyl-3,5-diphenyl-3,4-dihydropyrazol-4-yl]benzotriazole IUPAC Name: 1-[(3S,4S)-2-methyl-3,5-diphenyl-3,4-dihydropyrazol-4-yl]benzotriazole Traditional Name: 1-[(4S,5S)-1-methyl-3,5-diphenyl-2-pyrazolin-4-yl]benzotriazole Formula: C22H19N5 MolecularWeight: 353.41976

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(C(C(=N1)C2=CC=CC=C2)N3C4=CC=CC=C4N=N3)C5=CC=CC=C5

Isomeric SMILES

CN1[C@H]([C@@H](C(=N1)C2=CC=CC=C2)N3C4=CC=CC=C4N=N3)C5=CC=CC=C5

InChI

InChI=1S/C22H19N5/c1-26-21(17-12-6-3-7-13-17)22(20(24-26)16-10-4-2-5-11-16)27-19-15-9-8-14-18(19)23-25-27/h2-15,21-22H,1H3/t21-,22+/m0/s1