N-[3-[[5-(oxan-2-ylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]amino]phenyl]ethanamide

Systemtic Name: N-[3-[[5-(oxan-2-ylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]amino]phenyl]ethanamide Openeye Name: N-[3-[[5-(tetrahydropyran-2-ylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]amino]phenyl]acetamide CAS Name: N-[3-[[5-(2-oxanylmethylthio)-1,3,4-thiadiazol-2-yl]amino]phenyl]acetamide IUPAC Name: N-[3-[[5-(oxan-2-ylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]amino]phenyl]acetamide Traditional Name: N-[3-[[5-(tetrahydropyran-2-ylmethylthio)-1,3,4-thiadiazol-2-yl]amino]phenyl]acetamide Formula: C16H20N4O2S2 MolecularWeight: 364.4856

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=CC(=C1)NC2=NN=C(S2)SCC3CCCCO3

Isomeric SMILES

CC(=O)NC1=CC=CC(=C1)NC2=NN=C(S2)SCC3CCCCO3

InChI

InChI=1S/C16H20N4O2S2/c1-11(21)17-12-5-4-6-13(9-12)18-15-19-20-16(24-15)23-10-14-7-2-3-8-22-14/h4-6,9,14H,2-3,7-8,10H2,1H3,(H,17,21)(H,18,19)