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

Systemtic Name: 3-tert-butyl-5-[[4-(thiophen-2-ylmethyl)-1,4-diazepan-1-yl]methyl]-1,2,4-oxadiazole Openeye Name: 3-tert-butyl-5-[[4-(2-thienylmethyl)-1,4-diazepan-1-yl]methyl]-1,2,4-oxadiazole CAS Name: 3-tert-butyl-5-[[4-(thiophen-2-ylmethyl)-1,4-diazepan-1-yl]methyl]-1,2,4-oxadiazole IUPAC Name: 3-tert-butyl-5-[[4-(thiophen-2-ylmethyl)-1,4-diazepan-1-yl]methyl]-1,2,4-oxadiazole Traditional Name: 3-tert-butyl-5-[[4-(2-thenyl)-1,4-diazepan-1-yl]methyl]-1,2,4-oxadiazole Formula: C17H26N4OS MolecularWeight: 334.47954

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H26N4OS/c1-17(2,3)16-18-15(22-19-16)13-21-8-5-7-20(9-10-21)12-14-6-4-11-23-14/h4,6,11H,5,7-10,12-13H2,1-3H3