5-(1,4-diazepan-1-ylmethyl)-3-thiophen-2-yl-1,2,4-oxadiazole

Systemtic Name: 5-(1,4-diazepan-1-ylmethyl)-3-thiophen-2-yl-1,2,4-oxadiazole Openeye Name: 5-(1,4-diazepan-1-ylmethyl)-3-(2-thienyl)-1,2,4-oxadiazole CAS Name: 5-(1,4-diazepan-1-ylmethyl)-3-thiophen-2-yl-1,2,4-oxadiazole IUPAC Name: 5-(1,4-diazepan-1-ylmethyl)-3-thiophen-2-yl-1,2,4-oxadiazole Traditional Name: 5-(1,4-diazepan-1-ylmethyl)-3-(2-thienyl)-1,2,4-oxadiazole Formula: C12H16N4OS MolecularWeight: 264.34664

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CNCCN(C1)CC2=NC(=NO2)C3=CC=CS3

Isomeric SMILES

C1CNCCN(C1)CC2=NC(=NO2)C3=CC=CS3

InChI

InChI=1S/C12H16N4OS/c1-3-10(18-8-1)12-14-11(17-15-12)9-16-6-2-4-13-5-7-16/h1,3,8,13H,2,4-7,9H2