4-(piperazin-4-ium-1-ylmethyl)-2-thiophen-2-yl-1,3-oxazole

Systemtic Name: 4-(piperazin-4-ium-1-ylmethyl)-2-thiophen-2-yl-1,3-oxazole Openeye Name: 4-(piperazin-4-ium-1-ylmethyl)-2-(2-thienyl)oxazole CAS Name: 4-(1-piperazin-4-iumylmethyl)-2-thiophen-2-yloxazole IUPAC Name: 4-(piperazin-4-ium-1-ylmethyl)-2-thiophen-2-yl-1,3-oxazole Traditional Name: 4-(piperazin-4-ium-1-ylmethyl)-2-(2-thienyl)oxazole Formula: C12H16N3OS+ MolecularWeight: 250.33994

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)CC2=COC(=N2)C3=CC=CS3

Isomeric SMILES

C1CN(CC[NH2+]1)CC2=COC(=N2)C3=CC=CS3

InChI

InChI=1S/C12H15N3OS/c1-2-11(17-7-1)12-14-10(9-16-12)8-15-5-3-13-4-6-15/h1-2,7,9,13H,3-6,8H2/p+1