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

Systemtic Name: 3-octyl-5-[1-(triphenylmethyl)-5,6-dihydro-4H-pyrimidin-5-yl]-1,2,4-oxadiazole Openeye Name: 3-octyl-5-(1-trityl-5,6-dihydro-4H-pyrimidin-5-yl)-1,2,4-oxadiazole CAS Name: 3-octyl-5-[1-(triphenylmethyl)-5,6-dihydro-4H-pyrimidin-5-yl]-1,2,4-oxadiazole IUPAC Name: 3-octyl-5-(1-trityl-5,6-dihydro-4H-pyrimidin-5-yl)-1,2,4-oxadiazole Traditional Name: 3-octyl-5-(1-trityl-5,6-dihydro-4H-pyrimidin-5-yl)-1,2,4-oxadiazole Formula: C33H38N4O MolecularWeight: 506.68102

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=NOC(=N1)C2CN=CN(C2)C(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CCCCCCCCC1=NOC(=N1)C2CN=CN(C2)C(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C33H38N4O/c1-2-3-4-5-6-16-23-31-35-32(38-36-31)27-24-34-26-37(25-27)33(28-17-10-7-11-18-28,29-19-12-8-13-20-29)30-21-14-9-15-22-30/h7-15,17-22,26-27H,2-6,16,23-25H2,1H3