N-(5-methyl-1,2-oxazol-3-yl)-2-[(5-piperazin-4-ium-1-yl-1,3,4-thiadiazol-2-yl)sulfanyl]ethanamide

Systemtic Name: N-(5-methyl-1,2-oxazol-3-yl)-2-[(5-piperazin-4-ium-1-yl-1,3,4-thiadiazol-2-yl)sulfanyl]ethanamide Openeye Name: N-(5-methylisoxazol-3-yl)-2-[(5-piperazin-4-ium-1-yl-1,3,4-thiadiazol-2-yl)sulfanyl]acetamide CAS Name: N-(5-methyl-3-isoxazolyl)-2-[[5-(1-piperazin-4-iumyl)-1,3,4-thiadiazol-2-yl]thio]acetamide IUPAC Name: N-(5-methyl-1,2-oxazol-3-yl)-2-[(5-piperazin-4-ium-1-yl-1,3,4-thiadiazol-2-yl)sulfanyl]acetamide Traditional Name: N-(5-methylisoxazol-3-yl)-2-[(5-piperazin-4-ium-1-yl-1,3,4-thiadiazol-2-yl)thio]acetamide Formula: C12H17N6O2S2+ MolecularWeight: 341.43238

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC(=O)CSC2=NN=C(S2)N3CC[NH2+]CC3

Isomeric SMILES

CC1=CC(=NO1)NC(=O)CSC2=NN=C(S2)N3CC[NH2+]CC3

InChI

InChI=1S/C12H16N6O2S2/c1-8-6-9(17-20-8)14-10(19)7-21-12-16-15-11(22-12)18-4-2-13-3-5-18/h6,13H,2-5,7H2,1H3,(H,14,17,19)/p+1