3-(azepan-1-ylmethyl)-5-(phenoxymethyl)-1,3,4-oxadiazole-2-thione

Systemtic Name: 3-(azepan-1-ylmethyl)-5-(phenoxymethyl)-1,3,4-oxadiazole-2-thione Openeye Name: 3-(azepan-1-ylmethyl)-5-(phenoxymethyl)-1,3,4-oxadiazole-2-thione CAS Name: 3-(1-azepanylmethyl)-5-(phenoxymethyl)-1,3,4-oxadiazole-2-thione IUPAC Name: 3-(azepan-1-ylmethyl)-5-(phenoxymethyl)-1,3,4-oxadiazole-2-thione Traditional Name: 3-(azepan-1-ylmethyl)-5-(phenoxymethyl)-1,3,4-oxadiazole-2-thione Formula: C16H21N3O2S MolecularWeight: 319.42184

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)CN2C(=S)OC(=N2)COC3=CC=CC=C3

Isomeric SMILES

C1CCCN(CC1)CN2C(=S)OC(=N2)COC3=CC=CC=C3

InChI

InChI=1S/C16H21N3O2S/c22-16-19(13-18-10-6-1-2-7-11-18)17-15(21-16)12-20-14-8-4-3-5-9-14/h3-5,8-9H,1-2,6-7,10-13H2