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

Systemtic Name: 1-cyclohexyl-3-[5-(2-pyrrolidin-1-ium-1-ylethylsulfanyl)-1,3,4-thiadiazol-2-yl]urea Openeye Name: 1-cyclohexyl-3-[5-(2-pyrrolidin-1-ium-1-ylethylsulfanyl)-1,3,4-thiadiazol-2-yl]urea CAS Name: 1-cyclohexyl-3-[5-[2-(1-pyrrolidin-1-iumyl)ethylthio]-1,3,4-thiadiazol-2-yl]urea IUPAC Name: 1-cyclohexyl-3-[5-(2-pyrrolidin-1-ium-1-ylethylsulfanyl)-1,3,4-thiadiazol-2-yl]urea Traditional Name: 1-cyclohexyl-3-[5-(2-pyrrolidin-1-ium-1-ylethylthio)-1,3,4-thiadiazol-2-yl]urea Formula: C15H26N5OS2+ MolecularWeight: 356.52984

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)NC2=NN=C(S2)SCC[NH+]3CCCC3

Isomeric SMILES

C1CCC(CC1)NC(=O)NC2=NN=C(S2)SCC[NH+]3CCCC3

InChI

InChI=1S/C15H25N5OS2/c21-13(16-12-6-2-1-3-7-12)17-14-18-19-15(23-14)22-11-10-20-8-4-5-9-20/h12H,1-11H2,(H2,16,17,18,21)/p+1