3,4,5-trimethoxy-N-[5-(2-piperidin-1-ium-1-ylethyl)-1,3,4-thiadiazol-2-yl]benzamide

Systemtic Name: 3,4,5-trimethoxy-N-[5-(2-piperidin-1-ium-1-ylethyl)-1,3,4-thiadiazol-2-yl]benzamide Openeye Name: 3,4,5-trimethoxy-N-[5-(2-piperidin-1-ium-1-ylethyl)-1,3,4-thiadiazol-2-yl]benzamide CAS Name: 3,4,5-trimethoxy-N-[5-[2-(1-piperidin-1-iumyl)ethyl]-1,3,4-thiadiazol-2-yl]benzamide IUPAC Name: 3,4,5-trimethoxy-N-[5-(2-piperidin-1-ium-1-ylethyl)-1,3,4-thiadiazol-2-yl]benzamide Traditional Name: 3,4,5-trimethoxy-N-[5-(2-piperidin-1-ium-1-ylethyl)-1,3,4-thiadiazol-2-yl]benzamide Formula: C19H27N4O4S+ MolecularWeight: 407.50708

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)NC2=NN=C(S2)CC[NH+]3CCCCC3

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)NC2=NN=C(S2)CC[NH+]3CCCCC3

InChI

InChI=1S/C19H26N4O4S/c1-25-14-11-13(12-15(26-2)17(14)27-3)18(24)20-19-22-21-16(28-19)7-10-23-8-5-4-6-9-23/h11-12H,4-10H2,1-3H3,(H,20,22,24)/p+1