4-[3,4-bis(phenylmethoxy)-5-(phenylmethoxymethyl)oxolan-2-yl]-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-[3,4-bis(phenylmethoxy)-5-(phenylmethoxymethyl)oxolan-2-yl]-1H-1,2,4-triazole-5-thione Openeye Name: 4-[3,4-dibenzyloxy-5-(benzyloxymethyl)tetrahydrofuran-2-yl]-1H-1,2,4-triazole-5-thione CAS Name: 4-[3,4-bis(phenylmethoxy)-5-(phenylmethoxymethyl)-2-oxolanyl]-1H-1,2,4-triazole-5-thione IUPAC Name: 4-[3,4-bis(phenylmethoxy)-5-(phenylmethoxymethyl)oxolan-2-yl]-1H-1,2,4-triazole-5-thione Traditional Name: 4-[3,4-dibenzoxy-5-(benzoxymethyl)tetrahydrofuran-2-yl]-1H-1,2,4-triazole-5-thione Formula: C28H29N3O4S MolecularWeight: 503.61256

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COCC2C(C(C(O2)N3C=NNC3=S)OCC4=CC=CC=C4)OCC5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)COCC2C(C(C(O2)N3C=NNC3=S)OCC4=CC=CC=C4)OCC5=CC=CC=C5

InChI

InChI=1S/C28H29N3O4S/c36-28-30-29-20-31(28)27-26(34-18-23-14-8-3-9-15-23)25(33-17-22-12-6-2-7-13-22)24(35-27)19-32-16-21-10-4-1-5-11-21/h1-15,20,24-27H,16-19H2,(H,30,36)