4-[4-(2-butylimidazol-1-yl)-3-methyl-1-benzofuran-2-yl]-5-phenyl-3-(triphenylmethyl)-2H-1,2,3,4-tetrazole

Systemtic Name: 4-[4-(2-butylimidazol-1-yl)-3-methyl-1-benzofuran-2-yl]-5-phenyl-3-(triphenylmethyl)-2H-1,2,3,4-tetrazole Openeye Name: 4-[4-(2-butylimidazol-1-yl)-3-methyl-benzofuran-2-yl]-5-phenyl-3-trityl-2H-tetrazole CAS Name: 4-[4-(2-butyl-1-imidazolyl)-3-methyl-2-benzofuranyl]-5-phenyl-3-(triphenylmethyl)-2H-tetrazole IUPAC Name: 4-[4-(2-butylimidazol-1-yl)-3-methyl-1-benzofuran-2-yl]-5-phenyl-3-trityl-2H-tetrazole Traditional Name: 4-[4-(2-butylimidazol-1-yl)-3-methyl-benzofuran-2-yl]-5-phenyl-3-trityl-2H-tetrazole Formula: C42H38N6O MolecularWeight: 642.79072

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC=CN1C2=C3C(=C(OC3=CC=C2)N4C(=NNN4C(C5=CC=CC=C5)(C6=CC=CC=C6)C7=CC=CC=C7)C8=CC=CC=C8)C

Isomeric SMILES

CCCCC1=NC=CN1C2=C3C(=C(OC3=CC=C2)N4C(=NNN4C(C5=CC=CC=C5)(C6=CC=CC=C6)C7=CC=CC=C7)C8=CC=CC=C8)C

InChI

InChI=1S/C42H38N6O/c1-3-4-28-38-43-29-30-46(38)36-26-17-27-37-39(36)31(2)41(49-37)47-40(32-18-9-5-10-19-32)44-45-48(47)42(33-20-11-6-12-21-33,34-22-13-7-14-23-34)35-24-15-8-16-25-35/h5-27,29-30,45H,3-4,28H2,1-2H3