4-(phenylmethyl)-1,4,6-oxadiazocane-5-thione

Systemtic Name: 4-(phenylmethyl)-1,4,6-oxadiazocane-5-thione Openeye Name: 4-benzyl-1,4,6-oxadiazocane-5-thione CAS Name: 4-(phenylmethyl)-1,4,6-oxadiazocane-5-thione IUPAC Name: 4-benzyl-1,4,6-oxadiazocane-5-thione Traditional Name: 4-benzyl-1,4,6-oxadiazocane-5-thione Formula: C12H16N2OS MolecularWeight: 236.33324

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN(C(=S)N1)CC2=CC=CC=C2

Isomeric SMILES

C1COCCN(C(=S)N1)CC2=CC=CC=C2

InChI

InChI=1S/C12H16N2OS/c16-12-13-6-8-15-9-7-14(12)10-11-4-2-1-3-5-11/h1-5H,6-10H2,(H,13,16)