4-ethyl-N-[1-(phenylmethyl)piperidin-1-ium-4-yl]-1,2,3-thiadiazole-5-carboxamide

Systemtic Name: 4-ethyl-N-[1-(phenylmethyl)piperidin-1-ium-4-yl]-1,2,3-thiadiazole-5-carboxamide Openeye Name: N-(1-benzylpiperidin-1-ium-4-yl)-4-ethyl-thiadiazole-5-carboxamide CAS Name: 4-ethyl-N-[1-(phenylmethyl)-4-piperidin-1-iumyl]-5-thiadiazolecarboxamide IUPAC Name: N-(1-benzylpiperidin-1-ium-4-yl)-4-ethylthiadiazole-5-carboxamide Traditional Name: N-(1-benzylpiperidin-1-ium-4-yl)-4-ethyl-thiadiazole-5-carboxamide Formula: C17H23N4OS+ MolecularWeight: 331.45572

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SN=N1)C(=O)NC2CC[NH+](CC2)CC3=CC=CC=C3

Isomeric SMILES

CCC1=C(SN=N1)C(=O)NC2CC[NH+](CC2)CC3=CC=CC=C3

InChI

InChI=1S/C17H22N4OS/c1-2-15-16(23-20-19-15)17(22)18-14-8-10-21(11-9-14)12-13-6-4-3-5-7-13/h3-7,14H,2,8-12H2,1H3,(H,18,22)/p+1