4-ethyl-N-[[4-[(4-methylpiperidin-1-ium-1-yl)methyl]phenyl]methyl]-1,2,3-thiadiazole-5-carboxamide

Systemtic Name: 4-ethyl-N-[[4-[(4-methylpiperidin-1-ium-1-yl)methyl]phenyl]methyl]-1,2,3-thiadiazole-5-carboxamide Openeye Name: 4-ethyl-N-[[4-[(4-methylpiperidin-1-ium-1-yl)methyl]phenyl]methyl]thiadiazole-5-carboxamide CAS Name: 4-ethyl-N-[[4-[(4-methyl-1-piperidin-1-iumyl)methyl]phenyl]methyl]-5-thiadiazolecarboxamide IUPAC Name: 4-ethyl-N-[[4-[(4-methylpiperidin-1-ium-1-yl)methyl]phenyl]methyl]thiadiazole-5-carboxamide Traditional Name: 4-ethyl-N-[4-[(4-methylpiperidin-1-ium-1-yl)methyl]benzyl]thiadiazole-5-carboxamide Formula: C19H27N4OS+ MolecularWeight: 359.50888

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SN=N1)C(=O)NCC2=CC=C(C=C2)C[NH+]3CCC(CC3)C

Isomeric SMILES

CCC1=C(SN=N1)C(=O)NCC2=CC=C(C=C2)C[NH+]3CCC(CC3)C

InChI

InChI=1S/C19H26N4OS/c1-3-17-18(25-22-21-17)19(24)20-12-15-4-6-16(7-5-15)13-23-10-8-14(2)9-11-23/h4-7,14H,3,8-13H2,1-2H3,(H,20,24)/p+1