1-cyclohexyl-3-[5-(2-piperidin-1-ium-1-ylethylsulfanyl)-1,3,4-thiadiazol-2-yl]urea

Systemtic Name: 1-cyclohexyl-3-[5-(2-piperidin-1-ium-1-ylethylsulfanyl)-1,3,4-thiadiazol-2-yl]urea Openeye Name: 1-cyclohexyl-3-[5-(2-piperidin-1-ium-1-ylethylsulfanyl)-1,3,4-thiadiazol-2-yl]urea CAS Name: 1-cyclohexyl-3-[5-[2-(1-piperidin-1-iumyl)ethylthio]-1,3,4-thiadiazol-2-yl]urea IUPAC Name: 1-cyclohexyl-3-[5-(2-piperidin-1-ium-1-ylethylsulfanyl)-1,3,4-thiadiazol-2-yl]urea Traditional Name: 1-cyclohexyl-3-[5-(2-piperidin-1-ium-1-ylethylthio)-1,3,4-thiadiazol-2-yl]urea Formula: C16H28N5OS2+ MolecularWeight: 370.55642

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)NC2=NN=C(S2)SCC[NH+]3CCCCC3

Isomeric SMILES

C1CCC(CC1)NC(=O)NC2=NN=C(S2)SCC[NH+]3CCCCC3

InChI

InChI=1S/C16H27N5OS2/c22-14(17-13-7-3-1-4-8-13)18-15-19-20-16(24-15)23-12-11-21-9-5-2-6-10-21/h13H,1-12H2,(H2,17,18,19,22)/p+1