3-propan-2-yl-5-[[4-(thiophen-2-ylmethyl)-1,4-diazepan-1-yl]methyl]-1,2,4-oxadiazole

Systemtic Name: 3-propan-2-yl-5-[[4-(thiophen-2-ylmethyl)-1,4-diazepan-1-yl]methyl]-1,2,4-oxadiazole Openeye Name: 3-isopropyl-5-[[4-(2-thienylmethyl)-1,4-diazepan-1-yl]methyl]-1,2,4-oxadiazole CAS Name: 3-propan-2-yl-5-[[4-(thiophen-2-ylmethyl)-1,4-diazepan-1-yl]methyl]-1,2,4-oxadiazole IUPAC Name: 3-propan-2-yl-5-[[4-(thiophen-2-ylmethyl)-1,4-diazepan-1-yl]methyl]-1,2,4-oxadiazole Traditional Name: 3-isopropyl-5-[[4-(2-thenyl)-1,4-diazepan-1-yl]methyl]-1,2,4-oxadiazole Formula: C16H24N4OS MolecularWeight: 320.45296

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NOC(=N1)CN2CCCN(CC2)CC3=CC=CS3

Isomeric SMILES

CC(C)C1=NOC(=N1)CN2CCCN(CC2)CC3=CC=CS3

InChI

InChI=1S/C16H24N4OS/c1-13(2)16-17-15(21-18-16)12-20-7-4-6-19(8-9-20)11-14-5-3-10-22-14/h3,5,10,13H,4,6-9,11-12H2,1-2H3