N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-2-[(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)sulfanyl]ethanamide

Systemtic Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-2-[(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)sulfanyl]ethanamide Openeye Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-2-[[5-(4-pyridyl)-1,3,4-oxadiazol-2-yl]sulfanyl]acetamide CAS Name: N-[3-(1-azepanylsulfonyl)-4-methylphenyl]-2-[(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)thio]acetamide IUPAC Name: N-[3-(azepan-1-ylsulfonyl)-4-methylphenyl]-2-[(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)sulfanyl]acetamide Traditional Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-2-[[5-(4-pyridyl)-1,3,4-oxadiazol-2-yl]thio]acetamide Formula: C22H25N5O4S2 MolecularWeight: 487.595

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CSC2=NN=C(O2)C3=CC=NC=C3)S(=O)(=O)N4CCCCCC4

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CSC2=NN=C(O2)C3=CC=NC=C3)S(=O)(=O)N4CCCCCC4

InChI

InChI=1S/C22H25N5O4S2/c1-16-6-7-18(14-19(16)33(29,30)27-12-4-2-3-5-13-27)24-20(28)15-32-22-26-25-21(31-22)17-8-10-23-11-9-17/h6-11,14H,2-5,12-13,15H2,1H3,(H,24,28)