5-azanyl-2-[(2S)-2-oxidanyl-3-(triphenylmethyl)oxy-propyl]-1,2,4-triazin-3-one

Systemtic Name: 5-azanyl-2-[(2S)-2-oxidanyl-3-(triphenylmethyl)oxy-propyl]-1,2,4-triazin-3-one Openeye Name: 5-amino-2-[(2S)-2-hydroxy-3-trityloxy-propyl]-1,2,4-triazin-3-one CAS Name: 5-amino-2-[(2S)-2-hydroxy-3-(triphenylmethyl)oxypropyl]-1,2,4-triazin-3-one IUPAC Name: 5-amino-2-[(2S)-2-hydroxy-3-trityloxypropyl]-1,2,4-triazin-3-one Traditional Name: 5-amino-2-[(2S)-2-hydroxy-3-trityloxy-propyl]-1,2,4-triazin-3-one Formula: C25H24N4O3 MolecularWeight: 428.48306

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)OCC(CN4C(=O)N=C(C=N4)N)O

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)OC[C@H](CN4C(=O)N=C(C=N4)N)O

InChI

InChI=1S/C25H24N4O3/c26-23-16-27-29(24(31)28-23)17-22(30)18-32-25(19-10-4-1-5-11-19,20-12-6-2-7-13-20)21-14-8-3-9-15-21/h1-16,22,30H,17-18H2,(H2,26,28,31)/t22-/m0/s1