3-[[4-[1,1-bis(oxidanylidene)thiolan-3-yl]piperazin-1-yl]methyl]-1,3-benzoxazole-2-thione

Systemtic Name: 3-[[4-[1,1-bis(oxidanylidene)thiolan-3-yl]piperazin-1-yl]methyl]-1,3-benzoxazole-2-thione Openeye Name: 3-[[4-(1,1-dioxothiolan-3-yl)piperazin-1-yl]methyl]-1,3-benzoxazole-2-thione CAS Name: 3-[[4-(1,1-dioxo-3-thiolanyl)-1-piperazinyl]methyl]-1,3-benzoxazole-2-thione IUPAC Name: 3-[[4-(1,1-dioxothiolan-3-yl)piperazin-1-yl]methyl]-1,3-benzoxazole-2-thione Traditional Name: 3-[[4-(1,1-diketothiolan-3-yl)piperazino]methyl]-1,3-benzoxazole-2-thione Formula: C16H21N3O3S2 MolecularWeight: 367.48624

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)CC1N2CCN(CC2)CN3C4=CC=CC=C4OC3=S

Isomeric SMILES

C1CS(=O)(=O)CC1N2CCN(CC2)CN3C4=CC=CC=C4OC3=S

InChI

InChI=1S/C16H21N3O3S2/c20-24(21)10-5-13(11-24)18-8-6-17(7-9-18)12-19-14-3-1-2-4-15(14)22-16(19)23/h1-4,13H,5-12H2