1-methyl-1-(1-methylpiperidin-1-ium-4-yl)-3-(5-pentyl-1,3,4-thiadiazol-2-yl)urea

Systemtic Name: 1-methyl-1-(1-methylpiperidin-1-ium-4-yl)-3-(5-pentyl-1,3,4-thiadiazol-2-yl)urea Openeye Name: 1-methyl-1-(1-methylpiperidin-1-ium-4-yl)-3-(5-pentyl-1,3,4-thiadiazol-2-yl)urea CAS Name: 1-methyl-1-(1-methyl-4-piperidin-1-iumyl)-3-(5-pentyl-1,3,4-thiadiazol-2-yl)urea IUPAC Name: 1-methyl-1-(1-methylpiperidin-1-ium-4-yl)-3-(5-pentyl-1,3,4-thiadiazol-2-yl)urea Traditional Name: 3-(5-amyl-1,3,4-thiadiazol-2-yl)-1-methyl-1-(1-methylpiperidin-1-ium-4-yl)urea Formula: C15H28N5OS+ MolecularWeight: 326.48072

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=NN=C(S1)NC(=O)N(C)C2CC[NH+](CC2)C

Isomeric SMILES

CCCCCC1=NN=C(S1)NC(=O)N(C)C2CC[NH+](CC2)C

InChI

InChI=1S/C15H27N5OS/c1-4-5-6-7-13-17-18-14(22-13)16-15(21)20(3)12-8-10-19(2)11-9-12/h12H,4-11H2,1-3H3,(H,16,18,21)/p+1