3-methyl-5-[1-methyl-3-(triphenylmethyl)-5,6-dihydro-4H-pyrimidin-1-ium-5-yl]-1,2,4-oxadiazole

Systemtic Name: 3-methyl-5-[1-methyl-3-(triphenylmethyl)-5,6-dihydro-4H-pyrimidin-1-ium-5-yl]-1,2,4-oxadiazole Openeye Name: 3-methyl-5-(1-methyl-3-trityl-5,6-dihydro-4H-pyrimidin-1-ium-5-yl)-1,2,4-oxadiazole CAS Name: 3-methyl-5-[1-methyl-3-(triphenylmethyl)-5,6-dihydro-4H-pyrimidin-1-ium-5-yl]-1,2,4-oxadiazole IUPAC Name: 3-methyl-5-(1-methyl-3-trityl-5,6-dihydro-4H-pyrimidin-1-ium-5-yl)-1,2,4-oxadiazole Traditional Name: 3-methyl-5-(1-methyl-3-trityl-5,6-dihydro-4H-pyrimidin-1-ium-5-yl)-1,2,4-oxadiazole Formula: C27H27N4O+ MolecularWeight: 423.52948

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=N1)C2CN(C=[N+](C2)C)C(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC1=NOC(=N1)C2CN(C=[N+](C2)C)C(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C27H27N4O/c1-21-28-26(32-29-21)22-18-30(2)20-31(19-22)27(23-12-6-3-7-13-23,24-14-8-4-9-15-24)25-16-10-5-11-17-25/h3-17,20,22H,18-19H2,1-2H3/q+1